USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 993 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 CYS SG : rot 180:sc= 0.0547 USER MOD Set 1.2: A 100 HIS : no HD1:sc= 0 X(o=0.055,f=0.055) USER MOD Set 2.1: A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 60 SER OG : rot 100:sc= 1.25 USER MOD Set 3.1: A 45 ASN : amide:sc= 1.05 K(o=1.4,f=-5.3!) USER MOD Set 3.2: A 47 ASN : amide:sc= 0.314 K(o=1.4,f=0.75) USER MOD Set 4.1: A 10 CYS SG : rot 19:sc= -2.74 USER MOD Set 4.2: A 13 ASN : amide:sc= 0.342 K(o=6.6,f=-3.2!) USER MOD Set 4.3: A 17 SER OG : rot -170:sc= 0.305 USER MOD Set 4.4: A 18 GLN : amide:sc= 2.13 K(o=6.6,f=-7.7!) USER MOD Set 4.5: A 25 LYS NZ :NH3+ -155:sc= 1.92 (180deg=0.63) USER MOD Set 4.6: A 36 SER OG : rot -85:sc= 1.71 USER MOD Set 4.7: A 62 GLN : amide:sc= 1.63 K(o=6.6,f=-3.6!) USER MOD Set 4.8: A 64 SER OG : rot -108:sc= 1.25 USER MOD Single : A 3 ASN : amide:sc= -0.0755 X(o=-0.075,f=-0.57) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 90:sc= -0.115 USER MOD Single : A 11 THR OG1 : rot 90:sc= 0.911 USER MOD Single : A 14 SER OG : rot -85:sc= 1.25 USER MOD Single : A 15 CYS SG : rot -102:sc= 0.11 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0.849 K(o=0.85,f=-0.009) USER MOD Single : A 27 TYR OH : rot 128:sc= 0.18 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 1.13 (180deg=1.13) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= 1.04 K(o=1,f=-3.1!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 MET CE :methyl -122:sc= -1.73 (180deg=-1.84) USER MOD Single : A 61 ASN : amide:sc= -0.0791 X(o=-0.079,f=-0.079) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.00405 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0212 USER MOD Single : A 73 ASN : amide:sc= 0.956 K(o=0.96,f=-0.017) USER MOD Single : A 74 ASN : amide:sc= 0.586 K(o=0.59,f=-0.051) USER MOD Single : A 80 THR OG1 : rot 100:sc= 0.82 USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 120:sc= 0.368 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0.828 K(o=0.83,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc=-0.00236 USER MOD Single : A 116 LYS NZ :NH3+ -167:sc= 0.915 (180deg=0.795) USER MOD Single : A 121 GLN : amide:sc= 0.0463 X(o=0.046,f=0) USER MOD Single : A 129 ASN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 148:sc= 1.27 (180deg=0.515) USER MOD Single : A 137 THR OG1 : rot -44:sc= 1.27 USER MOD Single : A 139 LYS NZ :NH3+ -166:sc= 1.28 (180deg=1.07) USER MOD ----------------------------------------------------------------- ATOM 35 N ASN A 3 6.670 3.623 -2.577 1.00 0.00 N ATOM 36 CA ASN A 3 6.749 3.622 -4.030 1.00 0.00 C ATOM 37 C ASN A 3 8.222 3.378 -4.368 1.00 0.00 C ATOM 38 O ASN A 3 9.101 3.971 -3.737 1.00 0.00 O ATOM 39 CB ASN A 3 6.260 4.974 -4.571 1.00 0.00 C ATOM 40 CG ASN A 3 5.874 4.896 -6.037 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.705 4.721 -6.359 1.00 0.00 O ATOM 42 ND2 ASN A 3 6.815 5.036 -6.953 1.00 0.00 N ATOM 0 HA ASN A 3 6.122 2.854 -4.483 1.00 0.00 H new ATOM 0 HB2 ASN A 3 5.402 5.308 -3.988 1.00 0.00 H new ATOM 0 HB3 ASN A 3 7.044 5.721 -4.442 1.00 0.00 H new ATOM 0 HD21 ASN A 3 6.572 4.999 -7.943 1.00 0.00 H new ATOM 0 HD22 ASN A 3 7.784 5.181 -6.670 1.00 0.00 H new ATOM 49 N LYS A 4 8.511 2.500 -5.326 1.00 0.00 N ATOM 50 CA LYS A 4 9.881 2.235 -5.768 1.00 0.00 C ATOM 51 C LYS A 4 10.437 3.465 -6.479 1.00 0.00 C ATOM 52 O LYS A 4 9.705 4.419 -6.754 1.00 0.00 O ATOM 53 CB LYS A 4 9.912 0.973 -6.661 1.00 0.00 C ATOM 54 CG LYS A 4 10.124 -0.361 -5.925 1.00 0.00 C ATOM 55 CD LYS A 4 9.049 -0.747 -4.894 1.00 0.00 C ATOM 56 CE LYS A 4 9.478 -0.406 -3.459 1.00 0.00 C ATOM 57 NZ LYS A 4 8.467 -0.849 -2.472 1.00 0.00 N ATOM 0 H LYS A 4 7.805 1.953 -5.818 1.00 0.00 H new ATOM 0 HA LYS A 4 10.521 2.037 -4.908 1.00 0.00 H new ATOM 0 HB2 LYS A 4 8.973 0.917 -7.212 1.00 0.00 H new ATOM 0 HB3 LYS A 4 10.707 1.091 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 4 10.187 -1.156 -6.668 1.00 0.00 H new ATOM 0 HG3 LYS A 4 11.088 -0.323 -5.417 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.120 -0.227 -5.128 1.00 0.00 H new ATOM 0 HD3 LYS A 4 8.844 -1.815 -4.967 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.434 -0.882 -3.241 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.629 0.670 -3.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.787 -0.604 -1.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 7.562 -0.376 -2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 8.341 -1.879 -2.542 1.00 0.00 H new ATOM 71 N ILE A 5 11.718 3.416 -6.830 1.00 0.00 N ATOM 72 CA ILE A 5 12.434 4.394 -7.638 1.00 0.00 C ATOM 73 C ILE A 5 13.365 3.559 -8.523 1.00 0.00 C ATOM 74 O ILE A 5 13.913 2.568 -8.037 1.00 0.00 O ATOM 75 CB ILE A 5 13.240 5.364 -6.735 1.00 0.00 C ATOM 76 CG1 ILE A 5 12.439 6.048 -5.601 1.00 0.00 C ATOM 77 CG2 ILE A 5 13.927 6.451 -7.586 1.00 0.00 C ATOM 78 CD1 ILE A 5 12.505 5.273 -4.277 1.00 0.00 C ATOM 0 H ILE A 5 12.319 2.645 -6.540 1.00 0.00 H new ATOM 0 HA ILE A 5 11.763 5.018 -8.228 1.00 0.00 H new ATOM 0 HB ILE A 5 13.969 4.722 -6.241 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.824 7.056 -5.447 1.00 0.00 H new ATOM 0 HG13 ILE A 5 11.398 6.148 -5.907 1.00 0.00 H new ATOM 0 HG21 ILE A 5 14.488 7.122 -6.935 1.00 0.00 H new ATOM 0 HG22 ILE A 5 14.608 5.981 -8.296 1.00 0.00 H new ATOM 0 HG23 ILE A 5 13.172 7.019 -8.129 1.00 0.00 H new ATOM 0 HD11 ILE A 5 11.926 5.799 -3.518 1.00 0.00 H new ATOM 0 HD12 ILE A 5 12.094 4.274 -4.419 1.00 0.00 H new ATOM 0 HD13 ILE A 5 13.543 5.195 -3.952 1.00 0.00 H new ATOM 90 N ILE A 6 13.580 3.937 -9.783 1.00 0.00 N ATOM 91 CA ILE A 6 14.444 3.198 -10.705 1.00 0.00 C ATOM 92 C ILE A 6 15.157 4.188 -11.629 1.00 0.00 C ATOM 93 O ILE A 6 14.608 5.249 -11.936 1.00 0.00 O ATOM 94 CB ILE A 6 13.621 2.123 -11.459 1.00 0.00 C ATOM 95 CG1 ILE A 6 14.528 1.266 -12.372 1.00 0.00 C ATOM 96 CG2 ILE A 6 12.442 2.725 -12.249 1.00 0.00 C ATOM 97 CD1 ILE A 6 13.842 0.014 -12.924 1.00 0.00 C ATOM 0 H ILE A 6 13.158 4.769 -10.195 1.00 0.00 H new ATOM 0 HA ILE A 6 15.218 2.657 -10.161 1.00 0.00 H new ATOM 0 HB ILE A 6 13.187 1.471 -10.701 1.00 0.00 H new ATOM 0 HG12 ILE A 6 14.871 1.879 -13.206 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.413 0.967 -11.811 1.00 0.00 H new ATOM 0 HG21 ILE A 6 11.900 1.928 -12.758 1.00 0.00 H new ATOM 0 HG22 ILE A 6 11.770 3.240 -11.563 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.821 3.433 -12.986 1.00 0.00 H new ATOM 0 HD11 ILE A 6 14.541 -0.535 -13.555 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.523 -0.621 -12.097 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.973 0.305 -13.514 1.00 0.00 H new ATOM 109 N TYR A 7 16.369 3.842 -12.074 1.00 0.00 N ATOM 110 CA TYR A 7 17.232 4.725 -12.846 1.00 0.00 C ATOM 111 C TYR A 7 17.835 3.944 -14.012 1.00 0.00 C ATOM 112 O TYR A 7 18.283 2.811 -13.826 1.00 0.00 O ATOM 113 CB TYR A 7 18.332 5.253 -11.904 1.00 0.00 C ATOM 114 CG TYR A 7 18.985 6.602 -12.169 1.00 0.00 C ATOM 115 CD1 TYR A 7 18.399 7.583 -12.997 1.00 0.00 C ATOM 116 CD2 TYR A 7 20.118 6.938 -11.401 1.00 0.00 C ATOM 117 CE1 TYR A 7 18.888 8.902 -12.994 1.00 0.00 C ATOM 118 CE2 TYR A 7 20.613 8.253 -11.395 1.00 0.00 C ATOM 119 CZ TYR A 7 19.978 9.249 -12.165 1.00 0.00 C ATOM 120 OH TYR A 7 20.393 10.543 -12.062 1.00 0.00 O ATOM 0 H TYR A 7 16.780 2.924 -11.902 1.00 0.00 H new ATOM 0 HA TYR A 7 16.673 5.566 -13.256 1.00 0.00 H new ATOM 0 HB2 TYR A 7 17.907 5.291 -10.901 1.00 0.00 H new ATOM 0 HB3 TYR A 7 19.127 4.507 -11.886 1.00 0.00 H new ATOM 0 HD1 TYR A 7 17.570 7.320 -13.637 1.00 0.00 H new ATOM 0 HD2 TYR A 7 20.610 6.178 -10.812 1.00 0.00 H new ATOM 0 HE1 TYR A 7 18.430 9.649 -13.625 1.00 0.00 H new ATOM 0 HE2 TYR A 7 21.480 8.501 -10.801 1.00 0.00 H new ATOM 0 HH TYR A 7 19.912 10.983 -11.330 1.00 0.00 H new ATOM 130 N PHE A 8 17.896 4.562 -15.191 1.00 0.00 N ATOM 131 CA PHE A 8 18.509 3.993 -16.394 1.00 0.00 C ATOM 132 C PHE A 8 19.634 4.926 -16.822 1.00 0.00 C ATOM 133 O PHE A 8 19.412 6.133 -16.927 1.00 0.00 O ATOM 134 CB PHE A 8 17.469 3.848 -17.516 1.00 0.00 C ATOM 135 CG PHE A 8 16.295 2.955 -17.164 1.00 0.00 C ATOM 136 CD1 PHE A 8 16.435 1.554 -17.181 1.00 0.00 C ATOM 137 CD2 PHE A 8 15.062 3.524 -16.798 1.00 0.00 C ATOM 138 CE1 PHE A 8 15.368 0.727 -16.793 1.00 0.00 C ATOM 139 CE2 PHE A 8 13.994 2.694 -16.425 1.00 0.00 C ATOM 140 CZ PHE A 8 14.150 1.300 -16.397 1.00 0.00 C ATOM 0 H PHE A 8 17.512 5.495 -15.341 1.00 0.00 H new ATOM 0 HA PHE A 8 18.900 2.997 -16.185 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.093 4.837 -17.778 1.00 0.00 H new ATOM 0 HB3 PHE A 8 17.961 3.449 -18.403 1.00 0.00 H new ATOM 0 HD1 PHE A 8 17.369 1.112 -17.495 1.00 0.00 H new ATOM 0 HD2 PHE A 8 14.938 4.597 -16.804 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.485 -0.347 -16.799 1.00 0.00 H new ATOM 0 HE2 PHE A 8 13.044 3.132 -16.157 1.00 0.00 H new ATOM 0 HZ PHE A 8 13.335 0.670 -16.072 1.00 0.00 H new ATOM 150 N LEU A 9 20.824 4.389 -17.089 1.00 0.00 N ATOM 151 CA LEU A 9 22.039 5.170 -17.293 1.00 0.00 C ATOM 152 C LEU A 9 22.716 4.774 -18.598 1.00 0.00 C ATOM 153 O LEU A 9 22.792 3.585 -18.921 1.00 0.00 O ATOM 154 CB LEU A 9 23.007 4.938 -16.120 1.00 0.00 C ATOM 155 CG LEU A 9 22.525 5.413 -14.737 1.00 0.00 C ATOM 156 CD1 LEU A 9 23.649 5.209 -13.716 1.00 0.00 C ATOM 157 CD2 LEU A 9 22.113 6.885 -14.744 1.00 0.00 C ATOM 0 H LEU A 9 20.971 3.383 -17.170 1.00 0.00 H new ATOM 0 HA LEU A 9 21.770 6.225 -17.343 1.00 0.00 H new ATOM 0 HB2 LEU A 9 23.223 3.871 -16.060 1.00 0.00 H new ATOM 0 HB3 LEU A 9 23.947 5.441 -16.347 1.00 0.00 H new ATOM 0 HG LEU A 9 21.647 4.824 -14.470 1.00 0.00 H new ATOM 0 HD11 LEU A 9 23.314 5.544 -12.734 1.00 0.00 H new ATOM 0 HD12 LEU A 9 23.911 4.152 -13.669 1.00 0.00 H new ATOM 0 HD13 LEU A 9 24.523 5.786 -14.017 1.00 0.00 H new ATOM 0 HD21 LEU A 9 21.780 7.174 -13.747 1.00 0.00 H new ATOM 0 HD22 LEU A 9 22.965 7.500 -15.035 1.00 0.00 H new ATOM 0 HD23 LEU A 9 21.300 7.032 -15.455 1.00 0.00 H new ATOM 169 N CYS A 10 23.241 5.762 -19.330 1.00 0.00 N ATOM 170 CA CYS A 10 23.990 5.557 -20.575 1.00 0.00 C ATOM 171 C CYS A 10 25.204 6.478 -20.667 1.00 0.00 C ATOM 172 O CYS A 10 25.401 7.372 -19.844 1.00 0.00 O ATOM 173 CB CYS A 10 23.070 5.809 -21.779 1.00 0.00 C ATOM 174 SG CYS A 10 21.893 4.454 -21.906 1.00 0.00 S ATOM 0 H CYS A 10 23.156 6.744 -19.069 1.00 0.00 H new ATOM 0 HA CYS A 10 24.347 4.527 -20.580 1.00 0.00 H new ATOM 0 HB2 CYS A 10 22.543 6.756 -21.659 1.00 0.00 H new ATOM 0 HB3 CYS A 10 23.658 5.885 -22.694 1.00 0.00 H new ATOM 0 HG CYS A 10 21.838 3.819 -20.773 1.00 0.00 H new ATOM 180 N THR A 11 25.994 6.286 -21.723 1.00 0.00 N ATOM 181 CA THR A 11 27.112 7.146 -22.093 1.00 0.00 C ATOM 182 C THR A 11 26.659 8.607 -22.252 1.00 0.00 C ATOM 183 O THR A 11 27.407 9.525 -21.920 1.00 0.00 O ATOM 184 CB THR A 11 27.735 6.580 -23.381 1.00 0.00 C ATOM 185 OG1 THR A 11 26.728 6.292 -24.342 1.00 0.00 O ATOM 186 CG2 THR A 11 28.428 5.241 -23.131 1.00 0.00 C ATOM 0 H THR A 11 25.867 5.502 -22.363 1.00 0.00 H new ATOM 0 HA THR A 11 27.865 7.155 -21.305 1.00 0.00 H new ATOM 0 HB THR A 11 28.438 7.338 -23.727 1.00 0.00 H new ATOM 0 HG1 THR A 11 26.573 7.082 -24.900 1.00 0.00 H new ATOM 0 HG21 THR A 11 28.856 4.873 -24.064 1.00 0.00 H new ATOM 0 HG22 THR A 11 29.221 5.374 -22.395 1.00 0.00 H new ATOM 0 HG23 THR A 11 27.702 4.520 -22.755 1.00 0.00 H new ATOM 194 N GLY A 12 25.416 8.822 -22.692 1.00 0.00 N ATOM 195 CA GLY A 12 24.742 10.105 -22.708 1.00 0.00 C ATOM 196 C GLY A 12 23.244 9.831 -22.647 1.00 0.00 C ATOM 197 O GLY A 12 22.777 8.831 -23.200 1.00 0.00 O ATOM 0 H GLY A 12 24.835 8.069 -23.061 1.00 0.00 H new ATOM 0 HA2 GLY A 12 25.056 10.715 -21.861 1.00 0.00 H new ATOM 0 HA3 GLY A 12 24.995 10.660 -23.611 1.00 0.00 H new ATOM 201 N ASN A 13 22.494 10.674 -21.939 1.00 0.00 N ATOM 202 CA ASN A 13 21.067 10.479 -21.674 1.00 0.00 C ATOM 203 C ASN A 13 20.214 10.878 -22.882 1.00 0.00 C ATOM 204 O ASN A 13 19.361 11.759 -22.774 1.00 0.00 O ATOM 205 CB ASN A 13 20.660 11.275 -20.426 1.00 0.00 C ATOM 206 CG ASN A 13 19.217 10.998 -19.991 1.00 0.00 C ATOM 207 OD1 ASN A 13 18.485 11.926 -19.678 1.00 0.00 O ATOM 208 ND2 ASN A 13 18.748 9.759 -19.954 1.00 0.00 N ATOM 0 H ASN A 13 22.867 11.528 -21.525 1.00 0.00 H new ATOM 0 HA ASN A 13 20.890 9.419 -21.492 1.00 0.00 H new ATOM 0 HB2 ASN A 13 21.336 11.028 -19.607 1.00 0.00 H new ATOM 0 HB3 ASN A 13 20.777 12.340 -20.626 1.00 0.00 H new ATOM 0 HD21 ASN A 13 17.785 9.587 -19.666 1.00 0.00 H new ATOM 0 HD22 ASN A 13 19.350 8.978 -20.213 1.00 0.00 H new ATOM 215 N SER A 14 20.446 10.265 -24.042 1.00 0.00 N ATOM 216 CA SER A 14 19.851 10.735 -25.291 1.00 0.00 C ATOM 217 C SER A 14 19.117 9.657 -26.082 1.00 0.00 C ATOM 218 O SER A 14 18.254 10.012 -26.887 1.00 0.00 O ATOM 219 CB SER A 14 20.938 11.403 -26.143 1.00 0.00 C ATOM 220 OG SER A 14 21.526 12.488 -25.444 1.00 0.00 O ATOM 0 H SER A 14 21.041 9.443 -24.142 1.00 0.00 H new ATOM 0 HA SER A 14 19.079 11.457 -25.024 1.00 0.00 H new ATOM 0 HB2 SER A 14 21.704 10.672 -26.402 1.00 0.00 H new ATOM 0 HB3 SER A 14 20.507 11.758 -27.079 1.00 0.00 H new ATOM 0 HG SER A 14 20.984 13.294 -25.575 1.00 0.00 H new ATOM 226 N CYS A 15 19.395 8.371 -25.846 1.00 0.00 N ATOM 227 CA CYS A 15 18.854 7.290 -26.663 1.00 0.00 C ATOM 228 C CYS A 15 18.336 6.183 -25.746 1.00 0.00 C ATOM 229 O CYS A 15 17.202 6.255 -25.279 1.00 0.00 O ATOM 230 CB CYS A 15 19.920 6.791 -27.661 1.00 0.00 C ATOM 231 SG CYS A 15 20.516 8.095 -28.771 1.00 0.00 S ATOM 0 H CYS A 15 19.998 8.055 -25.087 1.00 0.00 H new ATOM 0 HA CYS A 15 18.014 7.647 -27.260 1.00 0.00 H new ATOM 0 HB2 CYS A 15 20.764 6.379 -27.107 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.502 5.979 -28.255 1.00 0.00 H new ATOM 0 HG CYS A 15 19.950 7.967 -29.934 1.00 0.00 H new ATOM 237 N ARG A 16 19.165 5.175 -25.457 1.00 0.00 N ATOM 238 CA ARG A 16 18.753 3.947 -24.774 1.00 0.00 C ATOM 239 C ARG A 16 18.078 4.249 -23.436 1.00 0.00 C ATOM 240 O ARG A 16 16.980 3.755 -23.198 1.00 0.00 O ATOM 241 CB ARG A 16 19.984 3.051 -24.571 1.00 0.00 C ATOM 242 CG ARG A 16 20.541 2.383 -25.837 1.00 0.00 C ATOM 243 CD ARG A 16 22.000 1.954 -25.611 1.00 0.00 C ATOM 244 NE ARG A 16 22.880 3.134 -25.539 1.00 0.00 N ATOM 245 CZ ARG A 16 24.136 3.194 -25.094 1.00 0.00 C ATOM 246 NH1 ARG A 16 24.749 2.134 -24.590 1.00 0.00 N ATOM 247 NH2 ARG A 16 24.769 4.354 -25.198 1.00 0.00 N ATOM 0 H ARG A 16 20.157 5.191 -25.695 1.00 0.00 H new ATOM 0 HA ARG A 16 18.020 3.429 -25.392 1.00 0.00 H new ATOM 0 HB2 ARG A 16 20.776 3.650 -24.121 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.728 2.271 -23.854 1.00 0.00 H new ATOM 0 HG2 ARG A 16 19.935 1.515 -26.096 1.00 0.00 H new ATOM 0 HG3 ARG A 16 20.483 3.074 -26.678 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.077 1.379 -24.688 1.00 0.00 H new ATOM 0 HD3 ARG A 16 22.323 1.301 -26.422 1.00 0.00 H new ATOM 0 HE ARG A 16 22.480 4.012 -25.870 1.00 0.00 H new ATOM 0 HH11 ARG A 16 24.260 1.241 -24.534 1.00 0.00 H new ATOM 0 HH12 ARG A 16 25.710 2.211 -24.258 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.294 5.159 -25.607 1.00 0.00 H new ATOM 0 HH22 ARG A 16 25.731 4.441 -24.869 1.00 0.00 H new ATOM 261 N SER A 17 18.697 5.061 -22.572 1.00 0.00 N ATOM 262 CA SER A 17 18.158 5.311 -21.235 1.00 0.00 C ATOM 263 C SER A 17 16.845 6.099 -21.297 1.00 0.00 C ATOM 264 O SER A 17 15.913 5.799 -20.549 1.00 0.00 O ATOM 265 CB SER A 17 19.226 5.999 -20.378 1.00 0.00 C ATOM 266 OG SER A 17 19.809 7.112 -21.044 1.00 0.00 O ATOM 0 H SER A 17 19.567 5.553 -22.775 1.00 0.00 H new ATOM 0 HA SER A 17 17.908 4.362 -20.762 1.00 0.00 H new ATOM 0 HB2 SER A 17 18.780 6.331 -19.440 1.00 0.00 H new ATOM 0 HB3 SER A 17 20.005 5.280 -20.124 1.00 0.00 H new ATOM 0 HG SER A 17 20.587 7.425 -20.538 1.00 0.00 H new ATOM 272 N GLN A 18 16.749 7.057 -22.225 1.00 0.00 N ATOM 273 CA GLN A 18 15.543 7.840 -22.472 1.00 0.00 C ATOM 274 C GLN A 18 14.387 6.922 -22.887 1.00 0.00 C ATOM 275 O GLN A 18 13.321 6.947 -22.267 1.00 0.00 O ATOM 276 CB GLN A 18 15.853 8.905 -23.545 1.00 0.00 C ATOM 277 CG GLN A 18 16.518 10.166 -22.962 1.00 0.00 C ATOM 278 CD GLN A 18 15.527 11.058 -22.209 1.00 0.00 C ATOM 279 OE1 GLN A 18 14.337 11.068 -22.509 1.00 0.00 O ATOM 280 NE2 GLN A 18 15.953 11.805 -21.209 1.00 0.00 N ATOM 0 H GLN A 18 17.526 7.312 -22.835 1.00 0.00 H new ATOM 0 HA GLN A 18 15.230 8.349 -21.561 1.00 0.00 H new ATOM 0 HB2 GLN A 18 16.507 8.472 -24.301 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.928 9.187 -24.048 1.00 0.00 H new ATOM 0 HG2 GLN A 18 17.321 9.870 -22.287 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.975 10.738 -23.769 1.00 0.00 H new ATOM 0 HE21 GLN A 18 16.941 11.801 -20.954 1.00 0.00 H new ATOM 0 HE22 GLN A 18 15.295 12.386 -20.690 1.00 0.00 H new ATOM 289 N MET A 19 14.612 6.085 -23.902 1.00 0.00 N ATOM 290 CA MET A 19 13.629 5.112 -24.381 1.00 0.00 C ATOM 291 C MET A 19 13.235 4.124 -23.274 1.00 0.00 C ATOM 292 O MET A 19 12.051 3.819 -23.126 1.00 0.00 O ATOM 293 CB MET A 19 14.153 4.354 -25.617 1.00 0.00 C ATOM 294 CG MET A 19 14.385 5.265 -26.835 1.00 0.00 C ATOM 295 SD MET A 19 14.415 4.443 -28.452 1.00 0.00 S ATOM 296 CE MET A 19 15.819 3.313 -28.260 1.00 0.00 C ATOM 0 H MET A 19 15.491 6.064 -24.419 1.00 0.00 H new ATOM 0 HA MET A 19 12.738 5.668 -24.672 1.00 0.00 H new ATOM 0 HB2 MET A 19 15.088 3.857 -25.360 1.00 0.00 H new ATOM 0 HB3 MET A 19 13.441 3.574 -25.886 1.00 0.00 H new ATOM 0 HG2 MET A 19 13.602 6.024 -26.850 1.00 0.00 H new ATOM 0 HG3 MET A 19 15.332 5.787 -26.698 1.00 0.00 H new ATOM 0 HE1 MET A 19 15.955 2.742 -29.179 1.00 0.00 H new ATOM 0 HE2 MET A 19 16.722 3.887 -28.052 1.00 0.00 H new ATOM 0 HE3 MET A 19 15.625 2.629 -27.433 1.00 0.00 H new ATOM 306 N ALA A 20 14.198 3.636 -22.482 1.00 0.00 N ATOM 307 CA ALA A 20 13.936 2.677 -21.413 1.00 0.00 C ATOM 308 C ALA A 20 13.025 3.271 -20.347 1.00 0.00 C ATOM 309 O ALA A 20 12.075 2.609 -19.940 1.00 0.00 O ATOM 310 CB ALA A 20 15.251 2.194 -20.797 1.00 0.00 C ATOM 0 H ALA A 20 15.180 3.898 -22.568 1.00 0.00 H new ATOM 0 HA ALA A 20 13.420 1.820 -21.847 1.00 0.00 H new ATOM 0 HB1 ALA A 20 15.039 1.480 -20.001 1.00 0.00 H new ATOM 0 HB2 ALA A 20 15.857 1.713 -21.565 1.00 0.00 H new ATOM 0 HB3 ALA A 20 15.794 3.045 -20.386 1.00 0.00 H new ATOM 316 N GLU A 21 13.267 4.519 -19.942 1.00 0.00 N ATOM 317 CA GLU A 21 12.358 5.244 -19.055 1.00 0.00 C ATOM 318 C GLU A 21 10.946 5.291 -19.660 1.00 0.00 C ATOM 319 O GLU A 21 9.975 5.024 -18.953 1.00 0.00 O ATOM 320 CB GLU A 21 12.919 6.645 -18.755 1.00 0.00 C ATOM 321 CG GLU A 21 12.044 7.458 -17.784 1.00 0.00 C ATOM 322 CD GLU A 21 12.554 8.886 -17.503 1.00 0.00 C ATOM 323 OE1 GLU A 21 13.722 9.205 -17.817 1.00 0.00 O ATOM 324 OE2 GLU A 21 11.794 9.681 -16.903 1.00 0.00 O ATOM 0 H GLU A 21 14.092 5.052 -20.217 1.00 0.00 H new ATOM 0 HA GLU A 21 12.278 4.718 -18.104 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.920 6.545 -18.334 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.020 7.196 -19.690 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.035 7.520 -18.190 1.00 0.00 H new ATOM 0 HG3 GLU A 21 11.975 6.919 -16.839 1.00 0.00 H new ATOM 331 N GLY A 22 10.820 5.557 -20.965 1.00 0.00 N ATOM 332 CA GLY A 22 9.543 5.558 -21.672 1.00 0.00 C ATOM 333 C GLY A 22 8.778 4.258 -21.504 1.00 0.00 C ATOM 334 O GLY A 22 7.614 4.290 -21.098 1.00 0.00 O ATOM 0 H GLY A 22 11.615 5.780 -21.564 1.00 0.00 H new ATOM 0 HA2 GLY A 22 8.932 6.384 -21.308 1.00 0.00 H new ATOM 0 HA3 GLY A 22 9.720 5.736 -22.733 1.00 0.00 H new ATOM 338 N TRP A 23 9.421 3.125 -21.782 1.00 0.00 N ATOM 339 CA TRP A 23 8.793 1.819 -21.609 1.00 0.00 C ATOM 340 C TRP A 23 8.490 1.541 -20.141 1.00 0.00 C ATOM 341 O TRP A 23 7.414 1.040 -19.815 1.00 0.00 O ATOM 342 CB TRP A 23 9.701 0.724 -22.169 1.00 0.00 C ATOM 343 CG TRP A 23 9.741 0.669 -23.660 1.00 0.00 C ATOM 344 CD1 TRP A 23 10.759 1.081 -24.443 1.00 0.00 C ATOM 345 CD2 TRP A 23 8.712 0.175 -24.571 1.00 0.00 C ATOM 346 NE1 TRP A 23 10.451 0.839 -25.763 1.00 0.00 N ATOM 347 CE2 TRP A 23 9.193 0.293 -25.908 1.00 0.00 C ATOM 348 CE3 TRP A 23 7.417 -0.357 -24.399 1.00 0.00 C ATOM 349 CZ2 TRP A 23 8.425 -0.099 -27.017 1.00 0.00 C ATOM 350 CZ3 TRP A 23 6.653 -0.786 -25.499 1.00 0.00 C ATOM 351 CH2 TRP A 23 7.156 -0.664 -26.805 1.00 0.00 C ATOM 0 H TRP A 23 10.379 3.087 -22.129 1.00 0.00 H new ATOM 0 HA TRP A 23 7.850 1.823 -22.155 1.00 0.00 H new ATOM 0 HB2 TRP A 23 10.713 0.879 -21.795 1.00 0.00 H new ATOM 0 HB3 TRP A 23 9.365 -0.241 -21.789 1.00 0.00 H new ATOM 0 HD1 TRP A 23 11.675 1.531 -24.089 1.00 0.00 H new ATOM 0 HE1 TRP A 23 11.079 1.040 -26.541 1.00 0.00 H new ATOM 0 HE3 TRP A 23 7.005 -0.436 -23.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.805 0.032 -28.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 5.674 -1.212 -25.339 1.00 0.00 H new ATOM 0 HH2 TRP A 23 6.568 -1.004 -27.645 1.00 0.00 H new ATOM 362 N ALA A 24 9.430 1.862 -19.253 1.00 0.00 N ATOM 363 CA ALA A 24 9.325 1.547 -17.843 1.00 0.00 C ATOM 364 C ALA A 24 8.142 2.270 -17.214 1.00 0.00 C ATOM 365 O ALA A 24 7.388 1.633 -16.488 1.00 0.00 O ATOM 366 CB ALA A 24 10.648 1.871 -17.153 1.00 0.00 C ATOM 0 H ALA A 24 10.290 2.352 -19.501 1.00 0.00 H new ATOM 0 HA ALA A 24 9.134 0.481 -17.715 1.00 0.00 H new ATOM 0 HB1 ALA A 24 10.572 1.635 -16.092 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.446 1.279 -17.600 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.871 2.931 -17.274 1.00 0.00 H new ATOM 372 N LYS A 25 7.903 3.544 -17.546 1.00 0.00 N ATOM 373 CA LYS A 25 6.701 4.258 -17.102 1.00 0.00 C ATOM 374 C LYS A 25 5.438 3.461 -17.408 1.00 0.00 C ATOM 375 O LYS A 25 4.541 3.415 -16.566 1.00 0.00 O ATOM 376 CB LYS A 25 6.604 5.638 -17.767 1.00 0.00 C ATOM 377 CG LYS A 25 7.610 6.666 -17.221 1.00 0.00 C ATOM 378 CD LYS A 25 7.531 8.018 -17.953 1.00 0.00 C ATOM 379 CE LYS A 25 7.671 7.856 -19.476 1.00 0.00 C ATOM 380 NZ LYS A 25 7.758 9.149 -20.197 1.00 0.00 N ATOM 0 H LYS A 25 8.530 4.104 -18.124 1.00 0.00 H new ATOM 0 HA LYS A 25 6.784 4.385 -16.023 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.761 5.525 -18.840 1.00 0.00 H new ATOM 0 HB3 LYS A 25 5.594 6.025 -17.632 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.425 6.821 -16.158 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.620 6.265 -17.313 1.00 0.00 H new ATOM 0 HD2 LYS A 25 6.580 8.499 -17.725 1.00 0.00 H new ATOM 0 HD3 LYS A 25 8.317 8.677 -17.584 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.562 7.267 -19.691 1.00 0.00 H new ATOM 0 HE3 LYS A 25 6.818 7.293 -19.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 7.431 9.023 -21.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.159 9.853 -19.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.744 9.479 -20.201 1.00 0.00 H new ATOM 394 N GLN A 26 5.370 2.837 -18.589 1.00 0.00 N ATOM 395 CA GLN A 26 4.190 2.067 -18.968 1.00 0.00 C ATOM 396 C GLN A 26 4.051 0.827 -18.084 1.00 0.00 C ATOM 397 O GLN A 26 3.067 0.686 -17.356 1.00 0.00 O ATOM 398 CB GLN A 26 4.172 1.659 -20.457 1.00 0.00 C ATOM 399 CG GLN A 26 4.577 2.740 -21.464 1.00 0.00 C ATOM 400 CD GLN A 26 3.990 4.123 -21.183 1.00 0.00 C ATOM 401 OE1 GLN A 26 2.779 4.304 -21.091 1.00 0.00 O ATOM 402 NE2 GLN A 26 4.842 5.126 -21.035 1.00 0.00 N ATOM 0 H GLN A 26 6.112 2.852 -19.289 1.00 0.00 H new ATOM 0 HA GLN A 26 3.337 2.728 -18.815 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.838 0.806 -20.586 1.00 0.00 H new ATOM 0 HB3 GLN A 26 3.167 1.319 -20.706 1.00 0.00 H new ATOM 0 HG2 GLN A 26 5.664 2.817 -21.477 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.268 2.424 -22.460 1.00 0.00 H new ATOM 0 HE21 GLN A 26 5.845 4.959 -21.114 1.00 0.00 H new ATOM 0 HE22 GLN A 26 4.495 6.065 -20.842 1.00 0.00 H new ATOM 411 N TYR A 27 5.039 -0.068 -18.141 1.00 0.00 N ATOM 412 CA TYR A 27 4.926 -1.389 -17.523 1.00 0.00 C ATOM 413 C TYR A 27 4.928 -1.308 -15.996 1.00 0.00 C ATOM 414 O TYR A 27 4.184 -2.036 -15.339 1.00 0.00 O ATOM 415 CB TYR A 27 6.058 -2.307 -17.996 1.00 0.00 C ATOM 416 CG TYR A 27 6.042 -2.632 -19.477 1.00 0.00 C ATOM 417 CD1 TYR A 27 5.002 -3.411 -20.022 1.00 0.00 C ATOM 418 CD2 TYR A 27 7.089 -2.190 -20.303 1.00 0.00 C ATOM 419 CE1 TYR A 27 5.005 -3.738 -21.390 1.00 0.00 C ATOM 420 CE2 TYR A 27 7.127 -2.555 -21.658 1.00 0.00 C ATOM 421 CZ TYR A 27 6.074 -3.316 -22.215 1.00 0.00 C ATOM 422 OH TYR A 27 6.106 -3.647 -23.537 1.00 0.00 O ATOM 0 H TYR A 27 5.929 0.100 -18.611 1.00 0.00 H new ATOM 0 HA TYR A 27 3.969 -1.807 -17.836 1.00 0.00 H new ATOM 0 HB2 TYR A 27 7.012 -1.838 -17.752 1.00 0.00 H new ATOM 0 HB3 TYR A 27 6.008 -3.240 -17.434 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.200 -3.758 -19.387 1.00 0.00 H new ATOM 0 HD2 TYR A 27 7.869 -1.566 -19.893 1.00 0.00 H new ATOM 0 HE1 TYR A 27 4.192 -4.311 -21.810 1.00 0.00 H new ATOM 0 HE2 TYR A 27 7.961 -2.254 -22.275 1.00 0.00 H new ATOM 0 HH TYR A 27 6.242 -2.838 -24.074 1.00 0.00 H new ATOM 432 N LEU A 28 5.752 -0.423 -15.430 1.00 0.00 N ATOM 433 CA LEU A 28 5.884 -0.253 -13.983 1.00 0.00 C ATOM 434 C LEU A 28 4.726 0.552 -13.377 1.00 0.00 C ATOM 435 O LEU A 28 4.665 0.686 -12.154 1.00 0.00 O ATOM 436 CB LEU A 28 7.237 0.397 -13.645 1.00 0.00 C ATOM 437 CG LEU A 28 8.474 -0.368 -14.160 1.00 0.00 C ATOM 438 CD1 LEU A 28 9.743 0.384 -13.754 1.00 0.00 C ATOM 439 CD2 LEU A 28 8.550 -1.809 -13.640 1.00 0.00 C ATOM 0 H LEU A 28 6.352 0.201 -15.969 1.00 0.00 H new ATOM 0 HA LEU A 28 5.842 -1.246 -13.535 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.253 1.405 -14.060 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.315 0.497 -12.562 1.00 0.00 H new ATOM 0 HG LEU A 28 8.385 -0.423 -15.245 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.618 -0.156 -14.117 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.728 1.384 -14.187 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.789 0.460 -12.668 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.442 -2.293 -14.038 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.597 -1.801 -12.551 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.665 -2.359 -13.961 1.00 0.00 H new ATOM 451 N GLY A 29 3.815 1.091 -14.198 1.00 0.00 N ATOM 452 CA GLY A 29 2.576 1.730 -13.757 1.00 0.00 C ATOM 453 C GLY A 29 2.787 2.892 -12.783 1.00 0.00 C ATOM 454 O GLY A 29 1.911 3.166 -11.962 1.00 0.00 O ATOM 0 H GLY A 29 3.926 1.093 -15.212 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.037 2.095 -14.631 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.942 0.981 -13.281 1.00 0.00 H new ATOM 458 N ASP A 30 3.951 3.547 -12.851 1.00 0.00 N ATOM 459 CA ASP A 30 4.428 4.612 -11.962 1.00 0.00 C ATOM 460 C ASP A 30 4.520 4.206 -10.480 1.00 0.00 C ATOM 461 O ASP A 30 4.869 5.023 -9.627 1.00 0.00 O ATOM 462 CB ASP A 30 3.627 5.897 -12.209 1.00 0.00 C ATOM 463 CG ASP A 30 4.262 7.119 -11.529 1.00 0.00 C ATOM 464 OD1 ASP A 30 5.394 7.503 -11.897 1.00 0.00 O ATOM 465 OD2 ASP A 30 3.617 7.740 -10.653 1.00 0.00 O ATOM 0 H ASP A 30 4.632 3.332 -13.579 1.00 0.00 H new ATOM 0 HA ASP A 30 5.468 4.813 -12.220 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.555 6.077 -13.282 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.610 5.766 -11.839 1.00 0.00 H new ATOM 470 N GLU A 31 4.336 2.915 -10.163 1.00 0.00 N ATOM 471 CA GLU A 31 4.600 2.345 -8.835 1.00 0.00 C ATOM 472 C GLU A 31 6.105 2.373 -8.509 1.00 0.00 C ATOM 473 O GLU A 31 6.529 2.009 -7.410 1.00 0.00 O ATOM 474 CB GLU A 31 4.067 0.904 -8.707 1.00 0.00 C ATOM 475 CG GLU A 31 2.633 0.707 -9.209 1.00 0.00 C ATOM 476 CD GLU A 31 2.053 -0.644 -8.752 1.00 0.00 C ATOM 477 OE1 GLU A 31 2.246 -1.668 -9.447 1.00 0.00 O ATOM 478 OE2 GLU A 31 1.377 -0.696 -7.699 1.00 0.00 O ATOM 0 H GLU A 31 3.994 2.227 -10.834 1.00 0.00 H new ATOM 0 HA GLU A 31 4.067 2.968 -8.117 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.727 0.236 -9.261 1.00 0.00 H new ATOM 0 HB3 GLU A 31 4.116 0.604 -7.660 1.00 0.00 H new ATOM 0 HG2 GLU A 31 2.004 1.517 -8.841 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.617 0.761 -10.298 1.00 0.00 H new ATOM 485 N TRP A 32 6.906 2.816 -9.480 1.00 0.00 N ATOM 486 CA TRP A 32 8.334 2.998 -9.452 1.00 0.00 C ATOM 487 C TRP A 32 8.526 4.398 -10.038 1.00 0.00 C ATOM 488 O TRP A 32 8.050 4.670 -11.139 1.00 0.00 O ATOM 489 CB TRP A 32 9.032 1.916 -10.301 1.00 0.00 C ATOM 490 CG TRP A 32 8.682 0.473 -10.034 1.00 0.00 C ATOM 491 CD1 TRP A 32 7.444 -0.066 -10.119 1.00 0.00 C ATOM 492 CD2 TRP A 32 9.562 -0.662 -9.747 1.00 0.00 C ATOM 493 NE1 TRP A 32 7.476 -1.410 -9.852 1.00 0.00 N ATOM 494 CE2 TRP A 32 8.764 -1.845 -9.661 1.00 0.00 C ATOM 495 CE3 TRP A 32 10.955 -0.827 -9.580 1.00 0.00 C ATOM 496 CZ2 TRP A 32 9.310 -3.116 -9.451 1.00 0.00 C ATOM 497 CZ3 TRP A 32 11.517 -2.100 -9.354 1.00 0.00 C ATOM 498 CH2 TRP A 32 10.700 -3.246 -9.310 1.00 0.00 C ATOM 0 H TRP A 32 6.520 3.078 -10.387 1.00 0.00 H new ATOM 0 HA TRP A 32 8.767 2.907 -8.456 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.817 2.124 -11.349 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.108 2.029 -10.168 1.00 0.00 H new ATOM 0 HD1 TRP A 32 6.550 0.488 -10.364 1.00 0.00 H new ATOM 0 HE1 TRP A 32 6.651 -2.008 -9.802 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.601 0.037 -9.626 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 8.671 -3.985 -9.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.583 -2.197 -9.213 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.142 -4.221 -9.168 1.00 0.00 H new ATOM 509 N LYS A 33 9.146 5.312 -9.292 1.00 0.00 N ATOM 510 CA LYS A 33 9.537 6.635 -9.748 1.00 0.00 C ATOM 511 C LYS A 33 10.640 6.439 -10.783 1.00 0.00 C ATOM 512 O LYS A 33 11.787 6.174 -10.421 1.00 0.00 O ATOM 513 CB LYS A 33 10.015 7.492 -8.561 1.00 0.00 C ATOM 514 CG LYS A 33 8.954 7.919 -7.533 1.00 0.00 C ATOM 515 CD LYS A 33 7.839 8.836 -8.067 1.00 0.00 C ATOM 516 CE LYS A 33 6.629 8.075 -8.635 1.00 0.00 C ATOM 517 NZ LYS A 33 5.574 8.999 -9.113 1.00 0.00 N ATOM 0 H LYS A 33 9.397 5.140 -8.318 1.00 0.00 H new ATOM 0 HA LYS A 33 8.696 7.166 -10.195 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.792 6.938 -8.035 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.481 8.393 -8.960 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.494 7.022 -7.119 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.456 8.429 -6.711 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.501 9.488 -7.262 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.251 9.478 -8.846 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.954 7.437 -9.457 1.00 0.00 H new ATOM 0 HE3 LYS A 33 6.218 7.420 -7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.775 8.449 -9.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.246 9.590 -8.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.959 9.607 -9.864 1.00 0.00 H new ATOM 531 N VAL A 34 10.272 6.457 -12.056 1.00 0.00 N ATOM 532 CA VAL A 34 11.173 6.183 -13.154 1.00 0.00 C ATOM 533 C VAL A 34 11.988 7.450 -13.441 1.00 0.00 C ATOM 534 O VAL A 34 11.434 8.553 -13.443 1.00 0.00 O ATOM 535 CB VAL A 34 10.368 5.726 -14.391 1.00 0.00 C ATOM 536 CG1 VAL A 34 11.251 4.866 -15.292 1.00 0.00 C ATOM 537 CG2 VAL A 34 9.120 4.878 -14.086 1.00 0.00 C ATOM 0 H VAL A 34 9.320 6.667 -12.355 1.00 0.00 H new ATOM 0 HA VAL A 34 11.860 5.376 -12.898 1.00 0.00 H new ATOM 0 HB VAL A 34 10.040 6.656 -14.855 1.00 0.00 H new ATOM 0 HG11 VAL A 34 10.679 4.546 -16.163 1.00 0.00 H new ATOM 0 HG12 VAL A 34 12.114 5.447 -15.618 1.00 0.00 H new ATOM 0 HG13 VAL A 34 11.591 3.990 -14.739 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.626 4.609 -15.020 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.416 3.972 -13.557 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.433 5.452 -13.465 1.00 0.00 H new ATOM 547 N TYR A 35 13.279 7.282 -13.727 1.00 0.00 N ATOM 548 CA TYR A 35 14.198 8.338 -14.141 1.00 0.00 C ATOM 549 C TYR A 35 15.231 7.764 -15.114 1.00 0.00 C ATOM 550 O TYR A 35 15.446 6.548 -15.158 1.00 0.00 O ATOM 551 CB TYR A 35 14.943 8.890 -12.914 1.00 0.00 C ATOM 552 CG TYR A 35 14.092 9.604 -11.882 1.00 0.00 C ATOM 553 CD1 TYR A 35 13.710 10.944 -12.090 1.00 0.00 C ATOM 554 CD2 TYR A 35 13.714 8.942 -10.698 1.00 0.00 C ATOM 555 CE1 TYR A 35 12.949 11.623 -11.121 1.00 0.00 C ATOM 556 CE2 TYR A 35 12.964 9.618 -9.722 1.00 0.00 C ATOM 557 CZ TYR A 35 12.573 10.960 -9.929 1.00 0.00 C ATOM 558 OH TYR A 35 11.837 11.599 -8.976 1.00 0.00 O ATOM 0 H TYR A 35 13.730 6.369 -13.674 1.00 0.00 H new ATOM 0 HA TYR A 35 13.628 9.134 -14.621 1.00 0.00 H new ATOM 0 HB2 TYR A 35 15.455 8.063 -12.423 1.00 0.00 H new ATOM 0 HB3 TYR A 35 15.712 9.580 -13.261 1.00 0.00 H new ATOM 0 HD1 TYR A 35 14.003 11.452 -12.997 1.00 0.00 H new ATOM 0 HD2 TYR A 35 14.001 7.913 -10.540 1.00 0.00 H new ATOM 0 HE1 TYR A 35 12.652 12.648 -11.287 1.00 0.00 H new ATOM 0 HE2 TYR A 35 12.685 9.111 -8.810 1.00 0.00 H new ATOM 0 HH TYR A 35 11.671 10.989 -8.227 1.00 0.00 H new ATOM 568 N SER A 36 15.953 8.632 -15.821 1.00 0.00 N ATOM 569 CA SER A 36 17.111 8.260 -16.615 1.00 0.00 C ATOM 570 C SER A 36 18.155 9.375 -16.554 1.00 0.00 C ATOM 571 O SER A 36 17.819 10.524 -16.248 1.00 0.00 O ATOM 572 CB SER A 36 16.703 7.923 -18.054 1.00 0.00 C ATOM 573 OG SER A 36 16.113 9.007 -18.741 1.00 0.00 O ATOM 0 H SER A 36 15.742 9.629 -15.855 1.00 0.00 H new ATOM 0 HA SER A 36 17.559 7.357 -16.200 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.583 7.590 -18.604 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.002 7.088 -18.039 1.00 0.00 H new ATOM 0 HG SER A 36 15.155 9.041 -18.537 1.00 0.00 H new ATOM 579 N ALA A 37 19.418 9.032 -16.818 1.00 0.00 N ATOM 580 CA ALA A 37 20.540 9.957 -16.858 1.00 0.00 C ATOM 581 C ALA A 37 21.701 9.323 -17.637 1.00 0.00 C ATOM 582 O ALA A 37 21.534 8.326 -18.347 1.00 0.00 O ATOM 583 CB ALA A 37 20.951 10.343 -15.429 1.00 0.00 C ATOM 0 H ALA A 37 19.691 8.069 -17.016 1.00 0.00 H new ATOM 0 HA ALA A 37 20.250 10.872 -17.375 1.00 0.00 H new ATOM 0 HB1 ALA A 37 21.792 11.036 -15.467 1.00 0.00 H new ATOM 0 HB2 ALA A 37 20.110 10.820 -14.925 1.00 0.00 H new ATOM 0 HB3 ALA A 37 21.243 9.448 -14.880 1.00 0.00 H new ATOM 589 N GLY A 38 22.889 9.911 -17.530 1.00 0.00 N ATOM 590 CA GLY A 38 24.098 9.380 -18.123 1.00 0.00 C ATOM 591 C GLY A 38 25.308 10.216 -17.738 1.00 0.00 C ATOM 592 O GLY A 38 25.183 11.203 -17.008 1.00 0.00 O ATOM 0 H GLY A 38 23.034 10.782 -17.020 1.00 0.00 H new ATOM 0 HA2 GLY A 38 24.245 8.350 -17.797 1.00 0.00 H new ATOM 0 HA3 GLY A 38 23.996 9.360 -19.208 1.00 0.00 H new ATOM 596 N ILE A 39 26.473 9.810 -18.248 1.00 0.00 N ATOM 597 CA ILE A 39 27.740 10.536 -18.131 1.00 0.00 C ATOM 598 C ILE A 39 27.620 11.971 -18.680 1.00 0.00 C ATOM 599 O ILE A 39 28.322 12.865 -18.205 1.00 0.00 O ATOM 600 CB ILE A 39 28.847 9.675 -18.805 1.00 0.00 C ATOM 601 CG1 ILE A 39 29.492 8.746 -17.752 1.00 0.00 C ATOM 602 CG2 ILE A 39 29.927 10.490 -19.532 1.00 0.00 C ATOM 603 CD1 ILE A 39 30.286 7.584 -18.366 1.00 0.00 C ATOM 0 H ILE A 39 26.563 8.939 -18.771 1.00 0.00 H new ATOM 0 HA ILE A 39 28.018 10.678 -17.087 1.00 0.00 H new ATOM 0 HB ILE A 39 28.352 9.091 -19.581 1.00 0.00 H new ATOM 0 HG12 ILE A 39 30.155 9.334 -17.118 1.00 0.00 H new ATOM 0 HG13 ILE A 39 28.711 8.342 -17.108 1.00 0.00 H new ATOM 0 HG21 ILE A 39 30.659 9.813 -19.973 1.00 0.00 H new ATOM 0 HG22 ILE A 39 29.465 11.087 -20.318 1.00 0.00 H new ATOM 0 HG23 ILE A 39 30.425 11.150 -18.821 1.00 0.00 H new ATOM 0 HD11 ILE A 39 30.711 6.973 -17.570 1.00 0.00 H new ATOM 0 HD12 ILE A 39 29.622 6.973 -18.978 1.00 0.00 H new ATOM 0 HD13 ILE A 39 31.089 7.980 -18.987 1.00 0.00 H new ATOM 615 N GLU A 40 26.720 12.214 -19.635 1.00 0.00 N ATOM 616 CA GLU A 40 26.383 13.534 -20.138 1.00 0.00 C ATOM 617 C GLU A 40 24.896 13.565 -20.496 1.00 0.00 C ATOM 618 O GLU A 40 24.227 12.526 -20.520 1.00 0.00 O ATOM 619 CB GLU A 40 27.265 13.938 -21.335 1.00 0.00 C ATOM 620 CG GLU A 40 27.125 13.013 -22.556 1.00 0.00 C ATOM 621 CD GLU A 40 27.701 13.648 -23.830 1.00 0.00 C ATOM 622 OE1 GLU A 40 28.937 13.628 -24.030 1.00 0.00 O ATOM 623 OE2 GLU A 40 26.908 14.163 -24.651 1.00 0.00 O ATOM 0 H GLU A 40 26.192 11.469 -20.090 1.00 0.00 H new ATOM 0 HA GLU A 40 26.580 14.269 -19.358 1.00 0.00 H new ATOM 0 HB2 GLU A 40 27.012 14.956 -21.632 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.308 13.948 -21.018 1.00 0.00 H new ATOM 0 HG2 GLU A 40 27.637 12.071 -22.358 1.00 0.00 H new ATOM 0 HG3 GLU A 40 26.072 12.777 -22.713 1.00 0.00 H new ATOM 630 N ALA A 41 24.392 14.754 -20.816 1.00 0.00 N ATOM 631 CA ALA A 41 23.077 14.965 -21.384 1.00 0.00 C ATOM 632 C ALA A 41 23.160 16.221 -22.242 1.00 0.00 C ATOM 633 O ALA A 41 23.709 17.233 -21.801 1.00 0.00 O ATOM 634 CB ALA A 41 22.055 15.157 -20.262 1.00 0.00 C ATOM 0 H ALA A 41 24.911 15.622 -20.680 1.00 0.00 H new ATOM 0 HA ALA A 41 22.764 14.109 -21.982 1.00 0.00 H new ATOM 0 HB1 ALA A 41 21.067 15.316 -20.693 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.037 14.269 -19.630 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.332 16.024 -19.662 1.00 0.00 H new ATOM 640 N HIS A 42 22.583 16.156 -23.441 1.00 0.00 N ATOM 641 CA HIS A 42 22.466 17.287 -24.360 1.00 0.00 C ATOM 642 C HIS A 42 21.061 17.311 -24.984 1.00 0.00 C ATOM 643 O HIS A 42 20.841 17.965 -26.007 1.00 0.00 O ATOM 644 CB HIS A 42 23.607 17.229 -25.396 1.00 0.00 C ATOM 645 CG HIS A 42 24.950 17.623 -24.822 1.00 0.00 C ATOM 646 ND1 HIS A 42 26.023 16.800 -24.549 1.00 0.00 N ATOM 647 CD2 HIS A 42 25.323 18.893 -24.466 1.00 0.00 C ATOM 648 CE1 HIS A 42 27.009 17.555 -24.040 1.00 0.00 C ATOM 649 NE2 HIS A 42 26.634 18.847 -23.971 1.00 0.00 N ATOM 0 H HIS A 42 22.175 15.297 -23.809 1.00 0.00 H new ATOM 0 HA HIS A 42 22.578 18.231 -23.827 1.00 0.00 H new ATOM 0 HB2 HIS A 42 23.673 16.218 -25.799 1.00 0.00 H new ATOM 0 HB3 HIS A 42 23.367 17.889 -26.229 1.00 0.00 H new ATOM 0 HD1 HIS A 42 26.060 15.793 -24.707 1.00 0.00 H new ATOM 0 HD2 HIS A 42 24.711 19.779 -24.552 1.00 0.00 H new ATOM 0 HE1 HIS A 42 27.972 17.178 -23.728 1.00 0.00 H new ATOM 657 N GLY A 43 20.106 16.599 -24.373 1.00 0.00 N ATOM 658 CA GLY A 43 18.751 16.445 -24.879 1.00 0.00 C ATOM 659 C GLY A 43 18.591 15.059 -25.490 1.00 0.00 C ATOM 660 O GLY A 43 19.573 14.337 -25.699 1.00 0.00 O ATOM 0 H GLY A 43 20.265 16.106 -23.494 1.00 0.00 H new ATOM 0 HA2 GLY A 43 18.032 16.583 -24.071 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.542 17.210 -25.627 1.00 0.00 H new ATOM 664 N LEU A 44 17.343 14.683 -25.761 1.00 0.00 N ATOM 665 CA LEU A 44 17.003 13.372 -26.290 1.00 0.00 C ATOM 666 C LEU A 44 16.983 13.394 -27.816 1.00 0.00 C ATOM 667 O LEU A 44 16.711 14.425 -28.436 1.00 0.00 O ATOM 668 CB LEU A 44 15.697 12.845 -25.674 1.00 0.00 C ATOM 669 CG LEU A 44 14.384 13.494 -26.152 1.00 0.00 C ATOM 670 CD1 LEU A 44 13.237 12.791 -25.429 1.00 0.00 C ATOM 671 CD2 LEU A 44 14.262 14.999 -25.873 1.00 0.00 C ATOM 0 H LEU A 44 16.535 15.288 -25.617 1.00 0.00 H new ATOM 0 HA LEU A 44 17.779 12.664 -26.000 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.637 11.775 -25.872 1.00 0.00 H new ATOM 0 HB3 LEU A 44 15.760 12.966 -24.593 1.00 0.00 H new ATOM 0 HG LEU A 44 14.360 13.383 -27.236 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.288 13.225 -25.743 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.249 11.729 -25.674 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.354 12.916 -24.353 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.304 15.362 -26.246 1.00 0.00 H new ATOM 0 HD22 LEU A 44 14.323 15.176 -24.799 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.071 15.529 -26.375 1.00 0.00 H new ATOM 683 N ASN A 45 17.306 12.251 -28.417 1.00 0.00 N ATOM 684 CA ASN A 45 17.525 12.126 -29.853 1.00 0.00 C ATOM 685 C ASN A 45 16.180 12.172 -30.592 1.00 0.00 C ATOM 686 O ASN A 45 15.267 11.453 -30.182 1.00 0.00 O ATOM 687 CB ASN A 45 18.243 10.794 -30.115 1.00 0.00 C ATOM 688 CG ASN A 45 18.761 10.699 -31.539 1.00 0.00 C ATOM 689 OD1 ASN A 45 17.998 10.646 -32.495 1.00 0.00 O ATOM 690 ND2 ASN A 45 20.068 10.666 -31.707 1.00 0.00 N ATOM 0 H ASN A 45 17.424 11.373 -27.911 1.00 0.00 H new ATOM 0 HA ASN A 45 18.138 12.950 -30.218 1.00 0.00 H new ATOM 0 HB2 ASN A 45 19.075 10.687 -29.419 1.00 0.00 H new ATOM 0 HB3 ASN A 45 17.558 9.968 -29.922 1.00 0.00 H new ATOM 0 HD21 ASN A 45 20.460 10.595 -32.646 1.00 0.00 H new ATOM 0 HD22 ASN A 45 20.687 10.711 -30.898 1.00 0.00 H new ATOM 697 N PRO A 46 16.023 12.935 -31.688 1.00 0.00 N ATOM 698 CA PRO A 46 14.793 12.940 -32.480 1.00 0.00 C ATOM 699 C PRO A 46 14.317 11.546 -32.907 1.00 0.00 C ATOM 700 O PRO A 46 13.113 11.288 -32.948 1.00 0.00 O ATOM 701 CB PRO A 46 15.092 13.817 -33.700 1.00 0.00 C ATOM 702 CG PRO A 46 16.176 14.767 -33.197 1.00 0.00 C ATOM 703 CD PRO A 46 16.973 13.900 -32.223 1.00 0.00 C ATOM 0 HA PRO A 46 13.971 13.325 -31.876 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.439 13.224 -34.546 1.00 0.00 H new ATOM 0 HB3 PRO A 46 14.206 14.358 -34.032 1.00 0.00 H new ATOM 0 HG2 PRO A 46 16.799 15.135 -34.012 1.00 0.00 H new ATOM 0 HG3 PRO A 46 15.749 15.640 -32.703 1.00 0.00 H new ATOM 0 HD2 PRO A 46 17.798 13.398 -32.730 1.00 0.00 H new ATOM 0 HD3 PRO A 46 17.408 14.504 -31.427 1.00 0.00 H new ATOM 711 N ASN A 47 15.239 10.621 -33.195 1.00 0.00 N ATOM 712 CA ASN A 47 14.876 9.267 -33.596 1.00 0.00 C ATOM 713 C ASN A 47 14.356 8.484 -32.400 1.00 0.00 C ATOM 714 O ASN A 47 13.484 7.641 -32.574 1.00 0.00 O ATOM 715 CB ASN A 47 16.070 8.498 -34.153 1.00 0.00 C ATOM 716 CG ASN A 47 16.696 9.093 -35.401 1.00 0.00 C ATOM 717 OD1 ASN A 47 16.137 9.020 -36.491 1.00 0.00 O ATOM 718 ND2 ASN A 47 17.876 9.674 -35.262 1.00 0.00 N ATOM 0 H ASN A 47 16.244 10.791 -33.156 1.00 0.00 H new ATOM 0 HA ASN A 47 14.112 9.367 -34.367 1.00 0.00 H new ATOM 0 HB2 ASN A 47 16.834 8.433 -33.378 1.00 0.00 H new ATOM 0 HB3 ASN A 47 15.754 7.479 -34.375 1.00 0.00 H new ATOM 0 HD21 ASN A 47 18.345 10.076 -36.073 1.00 0.00 H new ATOM 0 HD22 ASN A 47 18.317 9.720 -34.343 1.00 0.00 H new ATOM 725 N ALA A 48 14.867 8.751 -31.194 1.00 0.00 N ATOM 726 CA ALA A 48 14.364 8.148 -29.971 1.00 0.00 C ATOM 727 C ALA A 48 12.921 8.605 -29.749 1.00 0.00 C ATOM 728 O ALA A 48 12.051 7.780 -29.474 1.00 0.00 O ATOM 729 CB ALA A 48 15.269 8.502 -28.779 1.00 0.00 C ATOM 0 H ALA A 48 15.644 9.395 -31.046 1.00 0.00 H new ATOM 0 HA ALA A 48 14.374 7.062 -30.062 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.875 8.041 -27.873 1.00 0.00 H new ATOM 0 HB2 ALA A 48 16.277 8.132 -28.965 1.00 0.00 H new ATOM 0 HB3 ALA A 48 15.297 9.584 -28.652 1.00 0.00 H new ATOM 735 N VAL A 49 12.645 9.902 -29.930 1.00 0.00 N ATOM 736 CA VAL A 49 11.289 10.441 -29.851 1.00 0.00 C ATOM 737 C VAL A 49 10.392 9.716 -30.865 1.00 0.00 C ATOM 738 O VAL A 49 9.357 9.174 -30.470 1.00 0.00 O ATOM 739 CB VAL A 49 11.301 11.977 -30.035 1.00 0.00 C ATOM 740 CG1 VAL A 49 9.891 12.580 -29.987 1.00 0.00 C ATOM 741 CG2 VAL A 49 12.136 12.652 -28.938 1.00 0.00 C ATOM 0 H VAL A 49 13.357 10.604 -30.135 1.00 0.00 H new ATOM 0 HA VAL A 49 10.871 10.260 -28.861 1.00 0.00 H new ATOM 0 HB VAL A 49 11.736 12.159 -31.018 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.952 13.660 -30.121 1.00 0.00 H new ATOM 0 HG12 VAL A 49 9.284 12.150 -30.783 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.434 12.359 -29.023 1.00 0.00 H new ATOM 0 HG21 VAL A 49 12.130 13.732 -29.088 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.711 12.419 -27.962 1.00 0.00 H new ATOM 0 HG23 VAL A 49 13.161 12.285 -28.984 1.00 0.00 H new ATOM 751 N LYS A 50 10.797 9.625 -32.141 1.00 0.00 N ATOM 752 CA LYS A 50 10.013 8.903 -33.146 1.00 0.00 C ATOM 753 C LYS A 50 9.798 7.451 -32.748 1.00 0.00 C ATOM 754 O LYS A 50 8.686 6.950 -32.891 1.00 0.00 O ATOM 755 CB LYS A 50 10.684 8.919 -34.526 1.00 0.00 C ATOM 756 CG LYS A 50 10.493 10.225 -35.307 1.00 0.00 C ATOM 757 CD LYS A 50 10.930 10.052 -36.774 1.00 0.00 C ATOM 758 CE LYS A 50 10.044 9.083 -37.587 1.00 0.00 C ATOM 759 NZ LYS A 50 8.704 9.648 -37.896 1.00 0.00 N ATOM 0 H LYS A 50 11.658 10.041 -32.497 1.00 0.00 H new ATOM 0 HA LYS A 50 9.056 9.423 -33.202 1.00 0.00 H new ATOM 0 HB2 LYS A 50 11.751 8.738 -34.400 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.289 8.094 -35.119 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.447 10.528 -35.268 1.00 0.00 H new ATOM 0 HG3 LYS A 50 11.074 11.021 -34.841 1.00 0.00 H new ATOM 0 HD2 LYS A 50 10.924 11.027 -37.261 1.00 0.00 H new ATOM 0 HD3 LYS A 50 11.958 9.691 -36.795 1.00 0.00 H new ATOM 0 HE2 LYS A 50 10.550 8.830 -38.519 1.00 0.00 H new ATOM 0 HE3 LYS A 50 9.922 8.155 -37.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 8.153 8.956 -38.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 8.206 9.865 -37.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.815 10.519 -38.453 1.00 0.00 H new ATOM 773 N ALA A 51 10.839 6.772 -32.270 1.00 0.00 N ATOM 774 CA ALA A 51 10.772 5.366 -31.919 1.00 0.00 C ATOM 775 C ALA A 51 9.689 5.155 -30.863 1.00 0.00 C ATOM 776 O ALA A 51 8.854 4.265 -31.025 1.00 0.00 O ATOM 777 CB ALA A 51 12.150 4.891 -31.443 1.00 0.00 C ATOM 0 H ALA A 51 11.756 7.190 -32.117 1.00 0.00 H new ATOM 0 HA ALA A 51 10.502 4.769 -32.790 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.100 3.835 -31.179 1.00 0.00 H new ATOM 0 HB2 ALA A 51 12.879 5.031 -32.241 1.00 0.00 H new ATOM 0 HB3 ALA A 51 12.452 5.469 -30.570 1.00 0.00 H new ATOM 783 N MET A 52 9.652 5.996 -29.827 1.00 0.00 N ATOM 784 CA MET A 52 8.642 5.882 -28.781 1.00 0.00 C ATOM 785 C MET A 52 7.256 6.254 -29.304 1.00 0.00 C ATOM 786 O MET A 52 6.272 5.590 -28.975 1.00 0.00 O ATOM 787 CB MET A 52 9.016 6.732 -27.562 1.00 0.00 C ATOM 788 CG MET A 52 10.335 6.297 -26.908 1.00 0.00 C ATOM 789 SD MET A 52 10.628 4.522 -26.655 1.00 0.00 S ATOM 790 CE MET A 52 9.162 4.101 -25.692 1.00 0.00 C ATOM 0 H MET A 52 10.311 6.763 -29.693 1.00 0.00 H new ATOM 0 HA MET A 52 8.607 4.839 -28.467 1.00 0.00 H new ATOM 0 HB2 MET A 52 9.094 7.776 -27.865 1.00 0.00 H new ATOM 0 HB3 MET A 52 8.215 6.673 -26.825 1.00 0.00 H new ATOM 0 HG2 MET A 52 11.152 6.685 -27.517 1.00 0.00 H new ATOM 0 HG3 MET A 52 10.401 6.787 -25.936 1.00 0.00 H new ATOM 0 HE1 MET A 52 9.465 3.675 -24.736 1.00 0.00 H new ATOM 0 HE2 MET A 52 8.571 5.000 -25.517 1.00 0.00 H new ATOM 0 HE3 MET A 52 8.563 3.374 -26.240 1.00 0.00 H new ATOM 800 N LYS A 53 7.146 7.256 -30.178 1.00 0.00 N ATOM 801 CA LYS A 53 5.867 7.580 -30.798 1.00 0.00 C ATOM 802 C LYS A 53 5.366 6.432 -31.667 1.00 0.00 C ATOM 803 O LYS A 53 4.153 6.273 -31.795 1.00 0.00 O ATOM 804 CB LYS A 53 5.949 8.881 -31.611 1.00 0.00 C ATOM 805 CG LYS A 53 5.520 10.107 -30.789 1.00 0.00 C ATOM 806 CD LYS A 53 6.523 10.498 -29.695 1.00 0.00 C ATOM 807 CE LYS A 53 5.920 11.455 -28.663 1.00 0.00 C ATOM 808 NZ LYS A 53 5.681 12.827 -29.175 1.00 0.00 N ATOM 0 H LYS A 53 7.922 7.851 -30.469 1.00 0.00 H new ATOM 0 HA LYS A 53 5.148 7.733 -29.993 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.970 9.022 -31.965 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.314 8.797 -32.493 1.00 0.00 H new ATOM 0 HG2 LYS A 53 5.381 10.954 -31.461 1.00 0.00 H new ATOM 0 HG3 LYS A 53 4.553 9.904 -30.328 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.874 9.598 -29.190 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.394 10.966 -30.155 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.976 11.042 -28.308 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.587 11.511 -27.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 5.273 13.413 -28.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.582 13.243 -29.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.021 12.788 -29.978 1.00 0.00 H new ATOM 822 N GLU A 54 6.255 5.602 -32.220 1.00 0.00 N ATOM 823 CA GLU A 54 5.869 4.487 -33.069 1.00 0.00 C ATOM 824 C GLU A 54 5.163 3.394 -32.247 1.00 0.00 C ATOM 825 O GLU A 54 4.439 2.572 -32.810 1.00 0.00 O ATOM 826 CB GLU A 54 7.071 4.001 -33.901 1.00 0.00 C ATOM 827 CG GLU A 54 6.643 3.004 -34.991 1.00 0.00 C ATOM 828 CD GLU A 54 7.785 2.640 -35.950 1.00 0.00 C ATOM 829 OE1 GLU A 54 8.601 1.762 -35.589 1.00 0.00 O ATOM 830 OE2 GLU A 54 7.840 3.192 -37.073 1.00 0.00 O ATOM 0 H GLU A 54 7.262 5.690 -32.087 1.00 0.00 H new ATOM 0 HA GLU A 54 5.128 4.813 -33.799 1.00 0.00 H new ATOM 0 HB2 GLU A 54 7.563 4.857 -34.363 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.802 3.530 -33.244 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.269 2.096 -34.519 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.818 3.430 -35.562 1.00 0.00 H new ATOM 837 N VAL A 55 5.291 3.427 -30.914 1.00 0.00 N ATOM 838 CA VAL A 55 4.625 2.491 -30.006 1.00 0.00 C ATOM 839 C VAL A 55 3.572 3.188 -29.129 1.00 0.00 C ATOM 840 O VAL A 55 2.898 2.529 -28.336 1.00 0.00 O ATOM 841 CB VAL A 55 5.684 1.707 -29.208 1.00 0.00 C ATOM 842 CG1 VAL A 55 6.493 0.820 -30.170 1.00 0.00 C ATOM 843 CG2 VAL A 55 6.615 2.640 -28.419 1.00 0.00 C ATOM 0 H VAL A 55 5.869 4.115 -30.432 1.00 0.00 H new ATOM 0 HA VAL A 55 4.057 1.766 -30.588 1.00 0.00 H new ATOM 0 HB VAL A 55 5.169 1.082 -28.479 1.00 0.00 H new ATOM 0 HG11 VAL A 55 7.243 0.264 -29.608 1.00 0.00 H new ATOM 0 HG12 VAL A 55 5.823 0.121 -30.671 1.00 0.00 H new ATOM 0 HG13 VAL A 55 6.987 1.446 -30.914 1.00 0.00 H new ATOM 0 HG21 VAL A 55 7.346 2.046 -27.871 1.00 0.00 H new ATOM 0 HG22 VAL A 55 7.133 3.306 -29.109 1.00 0.00 H new ATOM 0 HG23 VAL A 55 6.028 3.231 -27.716 1.00 0.00 H new ATOM 853 N GLY A 56 3.384 4.502 -29.294 1.00 0.00 N ATOM 854 CA GLY A 56 2.329 5.256 -28.632 1.00 0.00 C ATOM 855 C GLY A 56 2.770 5.710 -27.245 1.00 0.00 C ATOM 856 O GLY A 56 1.947 5.778 -26.330 1.00 0.00 O ATOM 0 H GLY A 56 3.972 5.074 -29.901 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.064 6.124 -29.236 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.434 4.640 -28.549 1.00 0.00 H new ATOM 860 N ILE A 57 4.065 5.990 -27.078 1.00 0.00 N ATOM 861 CA ILE A 57 4.666 6.445 -25.836 1.00 0.00 C ATOM 862 C ILE A 57 5.247 7.833 -26.122 1.00 0.00 C ATOM 863 O ILE A 57 5.511 8.190 -27.274 1.00 0.00 O ATOM 864 CB ILE A 57 5.711 5.399 -25.369 1.00 0.00 C ATOM 865 CG1 ILE A 57 5.007 4.076 -24.979 1.00 0.00 C ATOM 866 CG2 ILE A 57 6.574 5.931 -24.207 1.00 0.00 C ATOM 867 CD1 ILE A 57 5.950 2.900 -24.680 1.00 0.00 C ATOM 0 H ILE A 57 4.742 5.901 -27.835 1.00 0.00 H new ATOM 0 HA ILE A 57 3.956 6.536 -25.014 1.00 0.00 H new ATOM 0 HB ILE A 57 6.385 5.203 -26.203 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.387 4.257 -24.101 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.336 3.787 -25.788 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.293 5.168 -23.909 1.00 0.00 H new ATOM 0 HG22 ILE A 57 7.106 6.826 -24.529 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.933 6.176 -23.360 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.363 2.020 -24.417 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.553 2.684 -25.562 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.605 3.161 -23.848 1.00 0.00 H new ATOM 879 N ASP A 58 5.480 8.606 -25.065 1.00 0.00 N ATOM 880 CA ASP A 58 6.174 9.877 -25.136 1.00 0.00 C ATOM 881 C ASP A 58 7.352 9.870 -24.172 1.00 0.00 C ATOM 882 O ASP A 58 7.268 9.355 -23.051 1.00 0.00 O ATOM 883 CB ASP A 58 5.242 11.053 -24.819 1.00 0.00 C ATOM 884 CG ASP A 58 6.061 12.344 -24.868 1.00 0.00 C ATOM 885 OD1 ASP A 58 6.679 12.584 -25.931 1.00 0.00 O ATOM 886 OD2 ASP A 58 6.208 13.034 -23.837 1.00 0.00 O ATOM 0 H ASP A 58 5.184 8.357 -24.121 1.00 0.00 H new ATOM 0 HA ASP A 58 6.533 10.008 -26.157 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.425 11.094 -25.539 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.792 10.926 -23.834 1.00 0.00 H new ATOM 891 N ILE A 59 8.441 10.484 -24.625 1.00 0.00 N ATOM 892 CA ILE A 59 9.622 10.798 -23.835 1.00 0.00 C ATOM 893 C ILE A 59 10.000 12.281 -24.026 1.00 0.00 C ATOM 894 O ILE A 59 10.917 12.767 -23.375 1.00 0.00 O ATOM 895 CB ILE A 59 10.767 9.796 -24.154 1.00 0.00 C ATOM 896 CG1 ILE A 59 11.099 9.737 -25.663 1.00 0.00 C ATOM 897 CG2 ILE A 59 10.394 8.394 -23.627 1.00 0.00 C ATOM 898 CD1 ILE A 59 12.404 8.989 -25.966 1.00 0.00 C ATOM 0 H ILE A 59 8.526 10.788 -25.595 1.00 0.00 H new ATOM 0 HA ILE A 59 9.415 10.675 -22.772 1.00 0.00 H new ATOM 0 HB ILE A 59 11.665 10.151 -23.649 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.278 9.251 -26.190 1.00 0.00 H new ATOM 0 HG13 ILE A 59 11.171 10.752 -26.053 1.00 0.00 H new ATOM 0 HG21 ILE A 59 11.199 7.695 -23.853 1.00 0.00 H new ATOM 0 HG22 ILE A 59 10.244 8.439 -22.548 1.00 0.00 H new ATOM 0 HG23 ILE A 59 9.475 8.057 -24.108 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.579 8.984 -27.042 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.234 9.488 -25.466 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.327 7.963 -25.606 1.00 0.00 H new ATOM 910 N SER A 60 9.268 13.049 -24.839 1.00 0.00 N ATOM 911 CA SER A 60 9.488 14.491 -24.989 1.00 0.00 C ATOM 912 C SER A 60 9.344 15.217 -23.640 1.00 0.00 C ATOM 913 O SER A 60 10.047 16.189 -23.368 1.00 0.00 O ATOM 914 CB SER A 60 8.521 15.091 -26.024 1.00 0.00 C ATOM 915 OG SER A 60 8.280 14.209 -27.107 1.00 0.00 O ATOM 0 H SER A 60 8.505 12.688 -25.412 1.00 0.00 H new ATOM 0 HA SER A 60 10.508 14.633 -25.347 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.576 15.333 -25.538 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.933 16.026 -26.404 1.00 0.00 H new ATOM 0 HG SER A 60 7.422 13.754 -26.974 1.00 0.00 H new ATOM 921 N ASN A 61 8.456 14.712 -22.779 1.00 0.00 N ATOM 922 CA ASN A 61 8.191 15.198 -21.425 1.00 0.00 C ATOM 923 C ASN A 61 9.383 15.088 -20.455 1.00 0.00 C ATOM 924 O ASN A 61 9.384 15.769 -19.429 1.00 0.00 O ATOM 925 CB ASN A 61 6.994 14.388 -20.889 1.00 0.00 C ATOM 926 CG ASN A 61 6.754 14.561 -19.392 1.00 0.00 C ATOM 927 OD1 ASN A 61 6.193 15.559 -18.946 1.00 0.00 O ATOM 928 ND2 ASN A 61 7.160 13.585 -18.593 1.00 0.00 N ATOM 0 H ASN A 61 7.873 13.911 -23.022 1.00 0.00 H new ATOM 0 HA ASN A 61 7.986 16.267 -21.484 1.00 0.00 H new ATOM 0 HB2 ASN A 61 6.095 14.686 -21.428 1.00 0.00 H new ATOM 0 HB3 ASN A 61 7.158 13.332 -21.102 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.009 13.654 -17.587 1.00 0.00 H new ATOM 0 HD22 ASN A 61 7.624 12.765 -18.984 1.00 0.00 H new ATOM 935 N GLN A 62 10.404 14.275 -20.750 1.00 0.00 N ATOM 936 CA GLN A 62 11.468 13.914 -19.803 1.00 0.00 C ATOM 937 C GLN A 62 12.837 14.332 -20.347 1.00 0.00 C ATOM 938 O GLN A 62 13.759 13.519 -20.451 1.00 0.00 O ATOM 939 CB GLN A 62 11.369 12.414 -19.432 1.00 0.00 C ATOM 940 CG GLN A 62 11.272 11.551 -20.694 1.00 0.00 C ATOM 941 CD GLN A 62 11.445 10.057 -20.495 1.00 0.00 C ATOM 942 OE1 GLN A 62 10.546 9.377 -20.009 1.00 0.00 O ATOM 943 NE2 GLN A 62 12.543 9.519 -20.990 1.00 0.00 N ATOM 0 H GLN A 62 10.517 13.842 -21.667 1.00 0.00 H new ATOM 0 HA GLN A 62 11.338 14.465 -18.872 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.242 12.120 -18.850 1.00 0.00 H new ATOM 0 HB3 GLN A 62 10.495 12.247 -18.802 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.300 11.726 -21.155 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.027 11.893 -21.402 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.269 10.116 -21.386 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.666 8.506 -20.977 1.00 0.00 H new ATOM 952 N THR A 63 12.952 15.603 -20.730 1.00 0.00 N ATOM 953 CA THR A 63 14.176 16.185 -21.262 1.00 0.00 C ATOM 954 C THR A 63 15.383 15.833 -20.377 1.00 0.00 C ATOM 955 O THR A 63 15.312 15.873 -19.143 1.00 0.00 O ATOM 956 CB THR A 63 13.978 17.701 -21.455 1.00 0.00 C ATOM 957 OG1 THR A 63 13.301 18.287 -20.352 1.00 0.00 O ATOM 958 CG2 THR A 63 13.115 17.972 -22.690 1.00 0.00 C ATOM 0 H THR A 63 12.180 16.267 -20.677 1.00 0.00 H new ATOM 0 HA THR A 63 14.397 15.759 -22.241 1.00 0.00 H new ATOM 0 HB THR A 63 14.974 18.132 -21.559 1.00 0.00 H new ATOM 0 HG1 THR A 63 13.194 19.249 -20.507 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.984 19.047 -22.813 1.00 0.00 H new ATOM 0 HG22 THR A 63 13.605 17.562 -23.573 1.00 0.00 H new ATOM 0 HG23 THR A 63 12.141 17.500 -22.564 1.00 0.00 H new ATOM 966 N SER A 64 16.479 15.461 -21.034 1.00 0.00 N ATOM 967 CA SER A 64 17.659 14.871 -20.451 1.00 0.00 C ATOM 968 C SER A 64 18.337 15.687 -19.352 1.00 0.00 C ATOM 969 O SER A 64 18.265 16.919 -19.326 1.00 0.00 O ATOM 970 CB SER A 64 18.633 14.603 -21.597 1.00 0.00 C ATOM 971 OG SER A 64 17.967 14.014 -22.697 1.00 0.00 O ATOM 0 H SER A 64 16.562 15.574 -22.044 1.00 0.00 H new ATOM 0 HA SER A 64 17.347 13.962 -19.936 1.00 0.00 H new ATOM 0 HB2 SER A 64 19.101 15.537 -21.908 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.431 13.944 -21.255 1.00 0.00 H new ATOM 0 HG SER A 64 18.222 13.070 -22.767 1.00 0.00 H new ATOM 977 N ASP A 65 19.067 14.975 -18.493 1.00 0.00 N ATOM 978 CA ASP A 65 19.943 15.531 -17.464 1.00 0.00 C ATOM 979 C ASP A 65 21.055 14.525 -17.144 1.00 0.00 C ATOM 980 O ASP A 65 20.905 13.324 -17.394 1.00 0.00 O ATOM 981 CB ASP A 65 19.130 15.857 -16.198 1.00 0.00 C ATOM 982 CG ASP A 65 19.937 16.637 -15.143 1.00 0.00 C ATOM 983 OD1 ASP A 65 20.922 17.320 -15.502 1.00 0.00 O ATOM 984 OD2 ASP A 65 19.539 16.621 -13.956 1.00 0.00 O ATOM 0 H ASP A 65 19.063 13.955 -18.496 1.00 0.00 H new ATOM 0 HA ASP A 65 20.393 16.454 -17.830 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.252 16.439 -16.478 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.769 14.928 -15.756 1.00 0.00 H new ATOM 989 N ILE A 66 22.182 15.012 -16.624 1.00 0.00 N ATOM 990 CA ILE A 66 23.263 14.197 -16.085 1.00 0.00 C ATOM 991 C ILE A 66 22.808 13.550 -14.768 1.00 0.00 C ATOM 992 O ILE A 66 21.760 13.897 -14.214 1.00 0.00 O ATOM 993 CB ILE A 66 24.567 15.023 -15.902 1.00 0.00 C ATOM 994 CG1 ILE A 66 24.409 16.526 -15.560 1.00 0.00 C ATOM 995 CG2 ILE A 66 25.451 14.828 -17.135 1.00 0.00 C ATOM 996 CD1 ILE A 66 24.230 17.486 -16.754 1.00 0.00 C ATOM 0 H ILE A 66 22.370 16.013 -16.566 1.00 0.00 H new ATOM 0 HA ILE A 66 23.498 13.407 -16.799 1.00 0.00 H new ATOM 0 HB ILE A 66 25.032 14.624 -15.001 1.00 0.00 H new ATOM 0 HG12 ILE A 66 23.549 16.638 -14.900 1.00 0.00 H new ATOM 0 HG13 ILE A 66 25.287 16.842 -14.996 1.00 0.00 H new ATOM 0 HG21 ILE A 66 26.370 15.403 -17.019 1.00 0.00 H new ATOM 0 HG22 ILE A 66 25.696 13.771 -17.244 1.00 0.00 H new ATOM 0 HG23 ILE A 66 24.919 15.171 -18.022 1.00 0.00 H new ATOM 0 HD11 ILE A 66 24.130 18.508 -16.388 1.00 0.00 H new ATOM 0 HD12 ILE A 66 25.099 17.419 -17.408 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.334 17.211 -17.311 1.00 0.00 H new ATOM 1008 N ILE A 67 23.604 12.594 -14.277 1.00 0.00 N ATOM 1009 CA ILE A 67 23.354 11.902 -13.022 1.00 0.00 C ATOM 1010 C ILE A 67 23.247 12.936 -11.897 1.00 0.00 C ATOM 1011 O ILE A 67 23.990 13.923 -11.869 1.00 0.00 O ATOM 1012 CB ILE A 67 24.437 10.825 -12.772 1.00 0.00 C ATOM 1013 CG1 ILE A 67 24.288 9.705 -13.826 1.00 0.00 C ATOM 1014 CG2 ILE A 67 24.317 10.223 -11.359 1.00 0.00 C ATOM 1015 CD1 ILE A 67 25.451 8.710 -13.876 1.00 0.00 C ATOM 0 H ILE A 67 24.450 12.280 -14.752 1.00 0.00 H new ATOM 0 HA ILE A 67 22.407 11.365 -13.061 1.00 0.00 H new ATOM 0 HB ILE A 67 25.417 11.295 -12.854 1.00 0.00 H new ATOM 0 HG12 ILE A 67 23.368 9.157 -13.625 1.00 0.00 H new ATOM 0 HG13 ILE A 67 24.178 10.163 -14.809 1.00 0.00 H new ATOM 0 HG21 ILE A 67 25.093 9.470 -11.217 1.00 0.00 H new ATOM 0 HG22 ILE A 67 24.436 11.012 -10.616 1.00 0.00 H new ATOM 0 HG23 ILE A 67 23.337 9.760 -11.243 1.00 0.00 H new ATOM 0 HD11 ILE A 67 25.257 7.962 -14.645 1.00 0.00 H new ATOM 0 HD12 ILE A 67 26.374 9.240 -14.111 1.00 0.00 H new ATOM 0 HD13 ILE A 67 25.551 8.218 -12.908 1.00 0.00 H new ATOM 1027 N ASP A 68 22.345 12.675 -10.953 1.00 0.00 N ATOM 1028 CA ASP A 68 22.099 13.518 -9.791 1.00 0.00 C ATOM 1029 C ASP A 68 21.953 12.651 -8.542 1.00 0.00 C ATOM 1030 O ASP A 68 21.369 11.559 -8.580 1.00 0.00 O ATOM 1031 CB ASP A 68 20.846 14.373 -10.010 1.00 0.00 C ATOM 1032 CG ASP A 68 20.672 15.371 -8.856 1.00 0.00 C ATOM 1033 OD1 ASP A 68 20.119 14.985 -7.806 1.00 0.00 O ATOM 1034 OD2 ASP A 68 21.106 16.537 -8.994 1.00 0.00 O ATOM 0 H ASP A 68 21.750 11.847 -10.979 1.00 0.00 H new ATOM 0 HA ASP A 68 22.947 14.189 -9.651 1.00 0.00 H new ATOM 0 HB2 ASP A 68 20.925 14.910 -10.955 1.00 0.00 H new ATOM 0 HB3 ASP A 68 19.968 13.731 -10.080 1.00 0.00 H new ATOM 1039 N SER A 69 22.509 13.137 -7.431 1.00 0.00 N ATOM 1040 CA SER A 69 22.579 12.439 -6.158 1.00 0.00 C ATOM 1041 C SER A 69 21.212 11.991 -5.642 1.00 0.00 C ATOM 1042 O SER A 69 21.118 10.950 -4.986 1.00 0.00 O ATOM 1043 CB SER A 69 23.282 13.341 -5.136 1.00 0.00 C ATOM 1044 OG SER A 69 24.464 13.902 -5.694 1.00 0.00 O ATOM 0 H SER A 69 22.937 14.062 -7.398 1.00 0.00 H new ATOM 0 HA SER A 69 23.151 11.524 -6.309 1.00 0.00 H new ATOM 0 HB2 SER A 69 22.608 14.138 -4.822 1.00 0.00 H new ATOM 0 HB3 SER A 69 23.532 12.765 -4.245 1.00 0.00 H new ATOM 0 HG SER A 69 24.899 14.476 -5.029 1.00 0.00 H new ATOM 1050 N ASP A 70 20.154 12.737 -5.966 1.00 0.00 N ATOM 1051 CA ASP A 70 18.805 12.525 -5.442 1.00 0.00 C ATOM 1052 C ASP A 70 18.169 11.247 -5.992 1.00 0.00 C ATOM 1053 O ASP A 70 17.134 10.801 -5.494 1.00 0.00 O ATOM 1054 CB ASP A 70 17.919 13.737 -5.760 1.00 0.00 C ATOM 1055 CG ASP A 70 16.538 13.643 -5.087 1.00 0.00 C ATOM 1056 OD1 ASP A 70 16.469 13.637 -3.837 1.00 0.00 O ATOM 1057 OD2 ASP A 70 15.509 13.653 -5.801 1.00 0.00 O ATOM 0 H ASP A 70 20.213 13.522 -6.614 1.00 0.00 H new ATOM 0 HA ASP A 70 18.888 12.409 -4.361 1.00 0.00 H new ATOM 0 HB2 ASP A 70 18.420 14.647 -5.431 1.00 0.00 H new ATOM 0 HB3 ASP A 70 17.790 13.817 -6.839 1.00 0.00 H new ATOM 1062 N ILE A 71 18.789 10.640 -7.008 1.00 0.00 N ATOM 1063 CA ILE A 71 18.329 9.418 -7.634 1.00 0.00 C ATOM 1064 C ILE A 71 19.436 8.371 -7.499 1.00 0.00 C ATOM 1065 O ILE A 71 19.133 7.250 -7.105 1.00 0.00 O ATOM 1066 CB ILE A 71 17.932 9.699 -9.098 1.00 0.00 C ATOM 1067 CG1 ILE A 71 16.899 10.844 -9.256 1.00 0.00 C ATOM 1068 CG2 ILE A 71 17.353 8.418 -9.713 1.00 0.00 C ATOM 1069 CD1 ILE A 71 17.040 11.533 -10.613 1.00 0.00 C ATOM 0 H ILE A 71 19.648 11.003 -7.422 1.00 0.00 H new ATOM 0 HA ILE A 71 17.436 9.029 -7.146 1.00 0.00 H new ATOM 0 HB ILE A 71 18.838 10.020 -9.612 1.00 0.00 H new ATOM 0 HG12 ILE A 71 15.890 10.444 -9.151 1.00 0.00 H new ATOM 0 HG13 ILE A 71 17.037 11.574 -8.459 1.00 0.00 H new ATOM 0 HG21 ILE A 71 17.069 8.607 -10.748 1.00 0.00 H new ATOM 0 HG22 ILE A 71 18.103 7.628 -9.681 1.00 0.00 H new ATOM 0 HG23 ILE A 71 16.475 8.108 -9.147 1.00 0.00 H new ATOM 0 HD11 ILE A 71 16.302 12.331 -10.694 1.00 0.00 H new ATOM 0 HD12 ILE A 71 18.041 11.954 -10.705 1.00 0.00 H new ATOM 0 HD13 ILE A 71 16.877 10.806 -11.409 1.00 0.00 H new ATOM 1081 N LEU A 72 20.712 8.708 -7.735 1.00 0.00 N ATOM 1082 CA LEU A 72 21.787 7.703 -7.759 1.00 0.00 C ATOM 1083 C LEU A 72 21.870 6.909 -6.454 1.00 0.00 C ATOM 1084 O LEU A 72 22.032 5.693 -6.496 1.00 0.00 O ATOM 1085 CB LEU A 72 23.145 8.312 -8.175 1.00 0.00 C ATOM 1086 CG LEU A 72 23.953 9.082 -7.112 1.00 0.00 C ATOM 1087 CD1 LEU A 72 24.916 8.229 -6.280 1.00 0.00 C ATOM 1088 CD2 LEU A 72 24.805 10.164 -7.789 1.00 0.00 C ATOM 0 H LEU A 72 21.025 9.663 -7.911 1.00 0.00 H new ATOM 0 HA LEU A 72 21.525 6.983 -8.534 1.00 0.00 H new ATOM 0 HB2 LEU A 72 23.772 7.503 -8.549 1.00 0.00 H new ATOM 0 HB3 LEU A 72 22.965 8.988 -9.011 1.00 0.00 H new ATOM 0 HG LEU A 72 23.197 9.485 -6.438 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.436 8.863 -5.562 1.00 0.00 H new ATOM 0 HD12 LEU A 72 24.355 7.462 -5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.643 7.754 -6.939 1.00 0.00 H new ATOM 0 HD21 LEU A 72 25.374 10.705 -7.033 1.00 0.00 H new ATOM 0 HD22 LEU A 72 25.492 9.697 -8.495 1.00 0.00 H new ATOM 0 HD23 LEU A 72 24.155 10.859 -8.321 1.00 0.00 H new ATOM 1100 N ASN A 73 21.707 7.580 -5.307 1.00 0.00 N ATOM 1101 CA ASN A 73 21.804 6.966 -3.980 1.00 0.00 C ATOM 1102 C ASN A 73 20.432 6.571 -3.412 1.00 0.00 C ATOM 1103 O ASN A 73 20.341 6.115 -2.272 1.00 0.00 O ATOM 1104 CB ASN A 73 22.605 7.877 -3.017 1.00 0.00 C ATOM 1105 CG ASN A 73 21.752 8.675 -2.023 1.00 0.00 C ATOM 1106 OD1 ASN A 73 21.764 8.406 -0.825 1.00 0.00 O ATOM 1107 ND2 ASN A 73 21.008 9.674 -2.471 1.00 0.00 N ATOM 0 H ASN A 73 21.501 8.579 -5.276 1.00 0.00 H new ATOM 0 HA ASN A 73 22.355 6.031 -4.087 1.00 0.00 H new ATOM 0 HB2 ASN A 73 23.308 7.260 -2.457 1.00 0.00 H new ATOM 0 HB3 ASN A 73 23.196 8.576 -3.609 1.00 0.00 H new ATOM 0 HD21 ASN A 73 20.444 10.221 -1.821 1.00 0.00 H new ATOM 0 HD22 ASN A 73 20.999 9.897 -3.466 1.00 0.00 H new ATOM 1114 N ASN A 74 19.366 6.731 -4.201 1.00 0.00 N ATOM 1115 CA ASN A 74 17.976 6.631 -3.757 1.00 0.00 C ATOM 1116 C ASN A 74 17.160 5.625 -4.577 1.00 0.00 C ATOM 1117 O ASN A 74 16.200 5.048 -4.071 1.00 0.00 O ATOM 1118 CB ASN A 74 17.394 8.045 -3.885 1.00 0.00 C ATOM 1119 CG ASN A 74 15.922 8.176 -3.504 1.00 0.00 C ATOM 1120 OD1 ASN A 74 15.416 7.514 -2.603 1.00 0.00 O ATOM 1121 ND2 ASN A 74 15.218 9.077 -4.168 1.00 0.00 N ATOM 0 H ASN A 74 19.451 6.940 -5.196 1.00 0.00 H new ATOM 0 HA ASN A 74 17.933 6.260 -2.733 1.00 0.00 H new ATOM 0 HB2 ASN A 74 17.977 8.719 -3.258 1.00 0.00 H new ATOM 0 HB3 ASN A 74 17.518 8.380 -4.915 1.00 0.00 H new ATOM 0 HD21 ASN A 74 14.237 9.231 -3.934 1.00 0.00 H new ATOM 0 HD22 ASN A 74 15.656 9.618 -4.914 1.00 0.00 H new ATOM 1128 N ALA A 75 17.548 5.385 -5.831 1.00 0.00 N ATOM 1129 CA ALA A 75 16.942 4.403 -6.706 1.00 0.00 C ATOM 1130 C ALA A 75 17.055 3.021 -6.071 1.00 0.00 C ATOM 1131 O ALA A 75 18.124 2.627 -5.610 1.00 0.00 O ATOM 1132 CB ALA A 75 17.570 4.491 -8.097 1.00 0.00 C ATOM 0 H ALA A 75 18.318 5.889 -6.271 1.00 0.00 H new ATOM 0 HA ALA A 75 15.879 4.604 -6.836 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.110 3.750 -8.751 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.408 5.488 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 75 18.640 4.298 -8.026 1.00 0.00 H new ATOM 1138 N ASP A 76 15.943 2.289 -6.051 1.00 0.00 N ATOM 1139 CA ASP A 76 15.898 0.903 -5.593 1.00 0.00 C ATOM 1140 C ASP A 76 16.680 -0.007 -6.544 1.00 0.00 C ATOM 1141 O ASP A 76 17.198 -1.044 -6.129 1.00 0.00 O ATOM 1142 CB ASP A 76 14.447 0.418 -5.481 1.00 0.00 C ATOM 1143 CG ASP A 76 14.387 -1.024 -4.950 1.00 0.00 C ATOM 1144 OD1 ASP A 76 14.665 -1.237 -3.748 1.00 0.00 O ATOM 1145 OD2 ASP A 76 14.019 -1.942 -5.715 1.00 0.00 O ATOM 0 H ASP A 76 15.038 2.646 -6.356 1.00 0.00 H new ATOM 0 HA ASP A 76 16.361 0.859 -4.607 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.890 1.078 -4.816 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.966 0.470 -6.458 1.00 0.00 H new ATOM 1150 N LEU A 77 16.806 0.408 -7.810 1.00 0.00 N ATOM 1151 CA LEU A 77 17.593 -0.272 -8.831 1.00 0.00 C ATOM 1152 C LEU A 77 18.156 0.771 -9.787 1.00 0.00 C ATOM 1153 O LEU A 77 17.456 1.712 -10.166 1.00 0.00 O ATOM 1154 CB LEU A 77 16.704 -1.271 -9.599 1.00 0.00 C ATOM 1155 CG LEU A 77 17.408 -1.981 -10.777 1.00 0.00 C ATOM 1156 CD1 LEU A 77 18.576 -2.862 -10.320 1.00 0.00 C ATOM 1157 CD2 LEU A 77 16.408 -2.857 -11.528 1.00 0.00 C ATOM 0 H LEU A 77 16.348 1.251 -8.157 1.00 0.00 H new ATOM 0 HA LEU A 77 18.410 -0.823 -8.366 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.341 -2.026 -8.901 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.830 -0.742 -9.980 1.00 0.00 H new ATOM 0 HG LEU A 77 17.804 -1.198 -11.423 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.035 -3.337 -11.187 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.317 -2.247 -9.809 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.208 -3.629 -9.639 1.00 0.00 H new ATOM 0 HD21 LEU A 77 16.911 -3.355 -12.357 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.999 -3.606 -10.850 1.00 0.00 H new ATOM 0 HD23 LEU A 77 15.599 -2.237 -11.914 1.00 0.00 H new ATOM 1169 N VAL A 78 19.389 0.557 -10.231 1.00 0.00 N ATOM 1170 CA VAL A 78 20.016 1.314 -11.300 1.00 0.00 C ATOM 1171 C VAL A 78 20.327 0.307 -12.410 1.00 0.00 C ATOM 1172 O VAL A 78 20.627 -0.853 -12.132 1.00 0.00 O ATOM 1173 CB VAL A 78 21.265 2.036 -10.748 1.00 0.00 C ATOM 1174 CG1 VAL A 78 21.964 2.871 -11.829 1.00 0.00 C ATOM 1175 CG2 VAL A 78 20.904 2.976 -9.583 1.00 0.00 C ATOM 0 H VAL A 78 19.994 -0.168 -9.845 1.00 0.00 H new ATOM 0 HA VAL A 78 19.377 2.098 -11.706 1.00 0.00 H new ATOM 0 HB VAL A 78 21.936 1.251 -10.399 1.00 0.00 H new ATOM 0 HG11 VAL A 78 22.837 3.363 -11.401 1.00 0.00 H new ATOM 0 HG12 VAL A 78 22.278 2.220 -12.645 1.00 0.00 H new ATOM 0 HG13 VAL A 78 21.274 3.624 -12.210 1.00 0.00 H new ATOM 0 HG21 VAL A 78 21.806 3.467 -9.219 1.00 0.00 H new ATOM 0 HG22 VAL A 78 20.195 3.729 -9.929 1.00 0.00 H new ATOM 0 HG23 VAL A 78 20.454 2.398 -8.775 1.00 0.00 H new ATOM 1185 N VAL A 79 20.266 0.724 -13.669 1.00 0.00 N ATOM 1186 CA VAL A 79 20.525 -0.135 -14.812 1.00 0.00 C ATOM 1187 C VAL A 79 21.471 0.648 -15.712 1.00 0.00 C ATOM 1188 O VAL A 79 21.169 1.791 -16.056 1.00 0.00 O ATOM 1189 CB VAL A 79 19.202 -0.494 -15.529 1.00 0.00 C ATOM 1190 CG1 VAL A 79 19.426 -1.601 -16.572 1.00 0.00 C ATOM 1191 CG2 VAL A 79 18.075 -0.931 -14.574 1.00 0.00 C ATOM 0 H VAL A 79 20.032 1.683 -13.925 1.00 0.00 H new ATOM 0 HA VAL A 79 20.973 -1.085 -14.521 1.00 0.00 H new ATOM 0 HB VAL A 79 18.880 0.428 -16.013 1.00 0.00 H new ATOM 0 HG11 VAL A 79 18.481 -1.836 -17.062 1.00 0.00 H new ATOM 0 HG12 VAL A 79 20.146 -1.260 -17.316 1.00 0.00 H new ATOM 0 HG13 VAL A 79 19.810 -2.494 -16.078 1.00 0.00 H new ATOM 0 HG21 VAL A 79 17.180 -1.166 -15.150 1.00 0.00 H new ATOM 0 HG22 VAL A 79 18.391 -1.814 -14.018 1.00 0.00 H new ATOM 0 HG23 VAL A 79 17.855 -0.123 -13.877 1.00 0.00 H new ATOM 1201 N THR A 80 22.599 0.058 -16.099 1.00 0.00 N ATOM 1202 CA THR A 80 23.467 0.626 -17.125 1.00 0.00 C ATOM 1203 C THR A 80 23.200 -0.117 -18.427 1.00 0.00 C ATOM 1204 O THR A 80 23.122 -1.346 -18.435 1.00 0.00 O ATOM 1205 CB THR A 80 24.946 0.561 -16.707 1.00 0.00 C ATOM 1206 OG1 THR A 80 25.263 -0.610 -15.968 1.00 0.00 O ATOM 1207 CG2 THR A 80 25.296 1.775 -15.850 1.00 0.00 C ATOM 0 H THR A 80 22.935 -0.824 -15.712 1.00 0.00 H new ATOM 0 HA THR A 80 23.247 1.685 -17.263 1.00 0.00 H new ATOM 0 HB THR A 80 25.526 0.546 -17.630 1.00 0.00 H new ATOM 0 HG1 THR A 80 25.687 -1.266 -16.560 1.00 0.00 H new ATOM 0 HG21 THR A 80 26.345 1.723 -15.557 1.00 0.00 H new ATOM 0 HG22 THR A 80 25.124 2.686 -16.422 1.00 0.00 H new ATOM 0 HG23 THR A 80 24.670 1.783 -14.958 1.00 0.00 H new ATOM 1215 N LEU A 81 23.057 0.621 -19.529 1.00 0.00 N ATOM 1216 CA LEU A 81 22.660 0.060 -20.827 1.00 0.00 C ATOM 1217 C LEU A 81 23.864 0.061 -21.792 1.00 0.00 C ATOM 1218 O LEU A 81 23.707 0.005 -23.015 1.00 0.00 O ATOM 1219 CB LEU A 81 21.421 0.795 -21.394 1.00 0.00 C ATOM 1220 CG LEU A 81 20.077 0.634 -20.638 1.00 0.00 C ATOM 1221 CD1 LEU A 81 20.065 1.256 -19.234 1.00 0.00 C ATOM 1222 CD2 LEU A 81 18.931 1.317 -21.396 1.00 0.00 C ATOM 0 H LEU A 81 23.213 1.629 -19.549 1.00 0.00 H new ATOM 0 HA LEU A 81 22.357 -0.979 -20.696 1.00 0.00 H new ATOM 0 HB2 LEU A 81 21.654 1.859 -21.440 1.00 0.00 H new ATOM 0 HB3 LEU A 81 21.271 0.457 -22.419 1.00 0.00 H new ATOM 0 HG LEU A 81 19.950 -0.446 -20.562 1.00 0.00 H new ATOM 0 HD11 LEU A 81 19.089 1.099 -18.775 1.00 0.00 H new ATOM 0 HD12 LEU A 81 20.834 0.786 -18.621 1.00 0.00 H new ATOM 0 HD13 LEU A 81 20.263 2.325 -19.308 1.00 0.00 H new ATOM 0 HD21 LEU A 81 18.001 1.188 -20.843 1.00 0.00 H new ATOM 0 HD22 LEU A 81 19.147 2.380 -21.500 1.00 0.00 H new ATOM 0 HD23 LEU A 81 18.830 0.869 -22.384 1.00 0.00 H new ATOM 1234 N CYS A 82 25.084 0.181 -21.254 1.00 0.00 N ATOM 1235 CA CYS A 82 26.329 0.240 -22.004 1.00 0.00 C ATOM 1236 C CYS A 82 26.614 -1.110 -22.677 1.00 0.00 C ATOM 1237 O CYS A 82 26.802 -2.115 -21.996 1.00 0.00 O ATOM 1238 CB CYS A 82 27.475 0.674 -21.074 1.00 0.00 C ATOM 1239 SG CYS A 82 27.680 -0.278 -19.537 1.00 0.00 S ATOM 0 H CYS A 82 25.228 0.241 -20.246 1.00 0.00 H new ATOM 0 HA CYS A 82 26.242 0.982 -22.797 1.00 0.00 H new ATOM 0 HB2 CYS A 82 28.408 0.621 -21.635 1.00 0.00 H new ATOM 0 HB3 CYS A 82 27.322 1.720 -20.809 1.00 0.00 H new ATOM 0 HG CYS A 82 28.682 0.200 -18.861 1.00 0.00 H new ATOM 1244 N GLY A 83 26.633 -1.145 -24.011 1.00 0.00 N ATOM 1245 CA GLY A 83 27.071 -2.290 -24.812 1.00 0.00 C ATOM 1246 C GLY A 83 27.350 -1.837 -26.249 1.00 0.00 C ATOM 1247 O GLY A 83 27.153 -2.584 -27.206 1.00 0.00 O ATOM 0 H GLY A 83 26.335 -0.353 -24.581 1.00 0.00 H new ATOM 0 HA2 GLY A 83 27.970 -2.728 -24.377 1.00 0.00 H new ATOM 0 HA3 GLY A 83 26.304 -3.065 -24.807 1.00 0.00 H new ATOM 1327 N PRO A 90 28.609 4.366 -17.048 1.00 0.00 N ATOM 1328 CA PRO A 90 28.508 5.321 -15.946 1.00 0.00 C ATOM 1329 C PRO A 90 28.678 4.677 -14.567 1.00 0.00 C ATOM 1330 O PRO A 90 28.111 3.618 -14.286 1.00 0.00 O ATOM 1331 CB PRO A 90 27.134 5.980 -16.083 1.00 0.00 C ATOM 1332 CG PRO A 90 26.826 5.851 -17.570 1.00 0.00 C ATOM 1333 CD PRO A 90 27.505 4.555 -17.978 1.00 0.00 C ATOM 0 HA PRO A 90 29.318 6.047 -16.010 1.00 0.00 H new ATOM 0 HB2 PRO A 90 26.384 5.477 -15.472 1.00 0.00 H new ATOM 0 HB3 PRO A 90 27.155 7.023 -15.766 1.00 0.00 H new ATOM 0 HG2 PRO A 90 25.752 5.813 -17.753 1.00 0.00 H new ATOM 0 HG3 PRO A 90 27.215 6.699 -18.133 1.00 0.00 H new ATOM 0 HD2 PRO A 90 26.808 3.718 -17.930 1.00 0.00 H new ATOM 0 HD3 PRO A 90 27.866 4.611 -19.005 1.00 0.00 H new ATOM 1341 N MET A 91 29.459 5.334 -13.710 1.00 0.00 N ATOM 1342 CA MET A 91 29.750 4.889 -12.361 1.00 0.00 C ATOM 1343 C MET A 91 28.485 4.984 -11.506 1.00 0.00 C ATOM 1344 O MET A 91 27.687 5.915 -11.646 1.00 0.00 O ATOM 1345 CB MET A 91 30.876 5.740 -11.742 1.00 0.00 C ATOM 1346 CG MET A 91 32.200 5.690 -12.522 1.00 0.00 C ATOM 1347 SD MET A 91 32.273 6.708 -14.030 1.00 0.00 S ATOM 1348 CE MET A 91 33.933 6.268 -14.613 1.00 0.00 C ATOM 0 H MET A 91 29.916 6.214 -13.948 1.00 0.00 H new ATOM 0 HA MET A 91 30.084 3.852 -12.395 1.00 0.00 H new ATOM 0 HB2 MET A 91 30.542 6.776 -11.680 1.00 0.00 H new ATOM 0 HB3 MET A 91 31.054 5.401 -10.722 1.00 0.00 H new ATOM 0 HG2 MET A 91 33.004 6.003 -11.856 1.00 0.00 H new ATOM 0 HG3 MET A 91 32.399 4.654 -12.796 1.00 0.00 H new ATOM 0 HE1 MET A 91 34.148 6.805 -15.537 1.00 0.00 H new ATOM 0 HE2 MET A 91 34.668 6.540 -13.856 1.00 0.00 H new ATOM 0 HE3 MET A 91 33.981 5.195 -14.797 1.00 0.00 H new ATOM 1358 N THR A 92 28.349 4.044 -10.579 1.00 0.00 N ATOM 1359 CA THR A 92 27.231 3.902 -9.661 1.00 0.00 C ATOM 1360 C THR A 92 27.753 3.745 -8.221 1.00 0.00 C ATOM 1361 O THR A 92 28.902 3.327 -8.032 1.00 0.00 O ATOM 1362 CB THR A 92 26.436 2.662 -10.104 1.00 0.00 C ATOM 1363 OG1 THR A 92 27.299 1.541 -10.260 1.00 0.00 O ATOM 1364 CG2 THR A 92 25.746 2.901 -11.450 1.00 0.00 C ATOM 0 H THR A 92 29.056 3.322 -10.442 1.00 0.00 H new ATOM 0 HA THR A 92 26.589 4.782 -9.678 1.00 0.00 H new ATOM 0 HB THR A 92 25.693 2.469 -9.330 1.00 0.00 H new ATOM 0 HG1 THR A 92 27.019 0.826 -9.652 1.00 0.00 H new ATOM 0 HG21 THR A 92 25.192 2.008 -11.738 1.00 0.00 H new ATOM 0 HG22 THR A 92 25.059 3.742 -11.362 1.00 0.00 H new ATOM 0 HG23 THR A 92 26.496 3.123 -12.209 1.00 0.00 H new ATOM 1372 N PRO A 93 26.938 4.037 -7.191 1.00 0.00 N ATOM 1373 CA PRO A 93 27.302 3.737 -5.811 1.00 0.00 C ATOM 1374 C PRO A 93 27.266 2.211 -5.595 1.00 0.00 C ATOM 1375 O PRO A 93 26.320 1.557 -6.043 1.00 0.00 O ATOM 1376 CB PRO A 93 26.266 4.470 -4.954 1.00 0.00 C ATOM 1377 CG PRO A 93 25.031 4.484 -5.849 1.00 0.00 C ATOM 1378 CD PRO A 93 25.598 4.608 -7.260 1.00 0.00 C ATOM 0 HA PRO A 93 28.309 4.061 -5.549 1.00 0.00 H new ATOM 0 HB2 PRO A 93 26.078 3.950 -4.015 1.00 0.00 H new ATOM 0 HB3 PRO A 93 26.592 5.479 -4.700 1.00 0.00 H new ATOM 0 HG2 PRO A 93 24.444 3.573 -5.733 1.00 0.00 H new ATOM 0 HG3 PRO A 93 24.373 5.319 -5.608 1.00 0.00 H new ATOM 0 HD2 PRO A 93 24.979 4.073 -7.980 1.00 0.00 H new ATOM 0 HD3 PRO A 93 25.631 5.649 -7.580 1.00 0.00 H new ATOM 1386 N PRO A 94 28.238 1.618 -4.879 1.00 0.00 N ATOM 1387 CA PRO A 94 28.308 0.171 -4.685 1.00 0.00 C ATOM 1388 C PRO A 94 27.213 -0.344 -3.739 1.00 0.00 C ATOM 1389 O PRO A 94 26.878 -1.529 -3.771 1.00 0.00 O ATOM 1390 CB PRO A 94 29.711 -0.090 -4.129 1.00 0.00 C ATOM 1391 CG PRO A 94 30.042 1.200 -3.381 1.00 0.00 C ATOM 1392 CD PRO A 94 29.351 2.278 -4.216 1.00 0.00 C ATOM 0 HA PRO A 94 28.137 -0.364 -5.619 1.00 0.00 H new ATOM 0 HB2 PRO A 94 29.726 -0.954 -3.465 1.00 0.00 H new ATOM 0 HB3 PRO A 94 30.428 -0.288 -4.926 1.00 0.00 H new ATOM 0 HG2 PRO A 94 29.665 1.180 -2.358 1.00 0.00 H new ATOM 0 HG3 PRO A 94 31.118 1.366 -3.321 1.00 0.00 H new ATOM 0 HD2 PRO A 94 29.001 3.095 -3.586 1.00 0.00 H new ATOM 0 HD3 PRO A 94 30.039 2.709 -4.944 1.00 0.00 H new ATOM 1400 N HIS A 95 26.650 0.536 -2.900 1.00 0.00 N ATOM 1401 CA HIS A 95 25.590 0.203 -1.955 1.00 0.00 C ATOM 1402 C HIS A 95 24.271 -0.146 -2.665 1.00 0.00 C ATOM 1403 O HIS A 95 23.430 -0.835 -2.084 1.00 0.00 O ATOM 1404 CB HIS A 95 25.400 1.394 -1.000 1.00 0.00 C ATOM 1405 CG HIS A 95 24.431 1.135 0.129 1.00 0.00 C ATOM 1406 ND1 HIS A 95 24.677 0.399 1.268 1.00 0.00 N ATOM 1407 CD2 HIS A 95 23.141 1.591 0.214 1.00 0.00 C ATOM 1408 CE1 HIS A 95 23.563 0.411 2.020 1.00 0.00 C ATOM 1409 NE2 HIS A 95 22.593 1.128 1.420 1.00 0.00 N ATOM 0 H HIS A 95 26.928 1.517 -2.863 1.00 0.00 H new ATOM 0 HA HIS A 95 25.881 -0.686 -1.395 1.00 0.00 H new ATOM 0 HB2 HIS A 95 26.368 1.665 -0.578 1.00 0.00 H new ATOM 0 HB3 HIS A 95 25.051 2.253 -1.573 1.00 0.00 H new ATOM 0 HD2 HIS A 95 22.635 2.201 -0.520 1.00 0.00 H new ATOM 0 HE1 HIS A 95 23.460 -0.086 2.974 1.00 0.00 H new ATOM 0 HE2 HIS A 95 21.651 1.300 1.771 1.00 0.00 H new ATOM 1417 N VAL A 96 24.070 0.320 -3.902 1.00 0.00 N ATOM 1418 CA VAL A 96 22.787 0.219 -4.593 1.00 0.00 C ATOM 1419 C VAL A 96 22.840 -0.964 -5.568 1.00 0.00 C ATOM 1420 O VAL A 96 23.871 -1.231 -6.193 1.00 0.00 O ATOM 1421 CB VAL A 96 22.450 1.567 -5.264 1.00 0.00 C ATOM 1422 CG1 VAL A 96 21.101 1.538 -5.988 1.00 0.00 C ATOM 1423 CG2 VAL A 96 22.386 2.695 -4.214 1.00 0.00 C ATOM 0 H VAL A 96 24.797 0.779 -4.451 1.00 0.00 H new ATOM 0 HA VAL A 96 21.975 0.018 -3.894 1.00 0.00 H new ATOM 0 HB VAL A 96 23.244 1.749 -5.989 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.911 2.510 -6.443 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.121 0.772 -6.763 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.310 1.311 -5.274 1.00 0.00 H new ATOM 0 HG21 VAL A 96 22.147 3.638 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 96 21.615 2.464 -3.479 1.00 0.00 H new ATOM 0 HG23 VAL A 96 23.350 2.781 -3.714 1.00 0.00 H new ATOM 1433 N LYS A 97 21.720 -1.686 -5.684 1.00 0.00 N ATOM 1434 CA LYS A 97 21.552 -2.783 -6.629 1.00 0.00 C ATOM 1435 C LYS A 97 21.689 -2.231 -8.044 1.00 0.00 C ATOM 1436 O LYS A 97 21.145 -1.168 -8.359 1.00 0.00 O ATOM 1437 CB LYS A 97 20.180 -3.446 -6.405 1.00 0.00 C ATOM 1438 CG LYS A 97 20.014 -4.741 -7.217 1.00 0.00 C ATOM 1439 CD LYS A 97 18.652 -5.393 -6.940 1.00 0.00 C ATOM 1440 CE LYS A 97 18.506 -6.680 -7.765 1.00 0.00 C ATOM 1441 NZ LYS A 97 17.216 -7.370 -7.508 1.00 0.00 N ATOM 0 H LYS A 97 20.893 -1.517 -5.111 1.00 0.00 H new ATOM 0 HA LYS A 97 22.316 -3.546 -6.480 1.00 0.00 H new ATOM 0 HB2 LYS A 97 20.055 -3.667 -5.345 1.00 0.00 H new ATOM 0 HB3 LYS A 97 19.392 -2.745 -6.680 1.00 0.00 H new ATOM 0 HG2 LYS A 97 20.107 -4.522 -8.281 1.00 0.00 H new ATOM 0 HG3 LYS A 97 20.813 -5.438 -6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 97 18.558 -5.620 -5.878 1.00 0.00 H new ATOM 0 HD3 LYS A 97 17.850 -4.698 -7.190 1.00 0.00 H new ATOM 0 HE2 LYS A 97 18.582 -6.440 -8.825 1.00 0.00 H new ATOM 0 HE3 LYS A 97 19.330 -7.355 -7.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.162 -8.233 -8.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 17.153 -7.624 -6.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 16.429 -6.737 -7.756 1.00 0.00 H new ATOM 1455 N ARG A 98 22.370 -2.977 -8.908 1.00 0.00 N ATOM 1456 CA ARG A 98 22.618 -2.587 -10.289 1.00 0.00 C ATOM 1457 C ARG A 98 22.325 -3.754 -11.224 1.00 0.00 C ATOM 1458 O ARG A 98 22.496 -4.915 -10.848 1.00 0.00 O ATOM 1459 CB ARG A 98 24.058 -2.059 -10.419 1.00 0.00 C ATOM 1460 CG ARG A 98 24.407 -1.580 -11.839 1.00 0.00 C ATOM 1461 CD ARG A 98 25.763 -0.878 -11.836 1.00 0.00 C ATOM 1462 NE ARG A 98 26.232 -0.587 -13.199 1.00 0.00 N ATOM 1463 CZ ARG A 98 27.478 -0.216 -13.511 1.00 0.00 C ATOM 1464 NH1 ARG A 98 28.310 0.241 -12.580 1.00 0.00 N ATOM 1465 NH2 ARG A 98 27.882 -0.327 -14.770 1.00 0.00 N ATOM 0 H ARG A 98 22.770 -3.883 -8.663 1.00 0.00 H new ATOM 0 HA ARG A 98 21.948 -1.779 -10.582 1.00 0.00 H new ATOM 0 HB2 ARG A 98 24.199 -1.234 -9.720 1.00 0.00 H new ATOM 0 HB3 ARG A 98 24.753 -2.846 -10.128 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.429 -2.429 -12.523 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.637 -0.899 -12.201 1.00 0.00 H new ATOM 0 HD2 ARG A 98 25.690 0.051 -11.271 1.00 0.00 H new ATOM 0 HD3 ARG A 98 26.495 -1.504 -11.326 1.00 0.00 H new ATOM 0 HE ARG A 98 25.559 -0.674 -13.960 1.00 0.00 H new ATOM 0 HH11 ARG A 98 28.001 0.313 -11.611 1.00 0.00 H new ATOM 0 HH12 ARG A 98 29.257 0.520 -12.835 1.00 0.00 H new ATOM 0 HH21 ARG A 98 27.246 -0.690 -15.480 1.00 0.00 H new ATOM 0 HH22 ARG A 98 28.829 -0.049 -15.028 1.00 0.00 H new ATOM 1479 N GLU A 99 21.940 -3.430 -12.453 1.00 0.00 N ATOM 1480 CA GLU A 99 21.773 -4.334 -13.580 1.00 0.00 C ATOM 1481 C GLU A 99 22.591 -3.777 -14.750 1.00 0.00 C ATOM 1482 O GLU A 99 22.894 -2.580 -14.796 1.00 0.00 O ATOM 1483 CB GLU A 99 20.280 -4.412 -13.948 1.00 0.00 C ATOM 1484 CG GLU A 99 19.507 -5.497 -13.189 1.00 0.00 C ATOM 1485 CD GLU A 99 19.755 -6.889 -13.796 1.00 0.00 C ATOM 1486 OE1 GLU A 99 19.176 -7.187 -14.865 1.00 0.00 O ATOM 1487 OE2 GLU A 99 20.532 -7.681 -13.216 1.00 0.00 O ATOM 0 H GLU A 99 21.723 -2.465 -12.703 1.00 0.00 H new ATOM 0 HA GLU A 99 22.118 -5.339 -13.335 1.00 0.00 H new ATOM 0 HB2 GLU A 99 19.817 -3.445 -13.751 1.00 0.00 H new ATOM 0 HB3 GLU A 99 20.189 -4.597 -15.018 1.00 0.00 H new ATOM 0 HG2 GLU A 99 19.808 -5.496 -12.142 1.00 0.00 H new ATOM 0 HG3 GLU A 99 18.441 -5.272 -13.214 1.00 0.00 H new ATOM 1494 N HIS A 100 22.922 -4.637 -15.713 1.00 0.00 N ATOM 1495 CA HIS A 100 23.711 -4.297 -16.888 1.00 0.00 C ATOM 1496 C HIS A 100 23.019 -4.927 -18.094 1.00 0.00 C ATOM 1497 O HIS A 100 22.961 -6.153 -18.212 1.00 0.00 O ATOM 1498 CB HIS A 100 25.154 -4.787 -16.704 1.00 0.00 C ATOM 1499 CG HIS A 100 25.985 -4.727 -17.962 1.00 0.00 C ATOM 1500 ND1 HIS A 100 26.648 -3.628 -18.462 1.00 0.00 N ATOM 1501 CD2 HIS A 100 26.228 -5.769 -18.818 1.00 0.00 C ATOM 1502 CE1 HIS A 100 27.277 -4.003 -19.589 1.00 0.00 C ATOM 1503 NE2 HIS A 100 27.049 -5.304 -19.853 1.00 0.00 N ATOM 0 H HIS A 100 22.639 -5.617 -15.693 1.00 0.00 H new ATOM 0 HA HIS A 100 23.773 -3.220 -17.041 1.00 0.00 H new ATOM 0 HB2 HIS A 100 25.636 -4.186 -15.933 1.00 0.00 H new ATOM 0 HB3 HIS A 100 25.135 -5.815 -16.342 1.00 0.00 H new ATOM 0 HD2 HIS A 100 25.851 -6.776 -18.713 1.00 0.00 H new ATOM 0 HE1 HIS A 100 27.883 -3.350 -20.200 1.00 0.00 H new ATOM 0 HE2 HIS A 100 27.402 -5.841 -20.645 1.00 0.00 H new ATOM 1511 N TRP A 101 22.453 -4.085 -18.956 1.00 0.00 N ATOM 1512 CA TRP A 101 21.638 -4.457 -20.108 1.00 0.00 C ATOM 1513 C TRP A 101 22.326 -3.871 -21.347 1.00 0.00 C ATOM 1514 O TRP A 101 21.807 -2.958 -21.985 1.00 0.00 O ATOM 1515 CB TRP A 101 20.192 -3.936 -19.947 1.00 0.00 C ATOM 1516 CG TRP A 101 19.273 -4.546 -18.922 1.00 0.00 C ATOM 1517 CD1 TRP A 101 19.601 -5.335 -17.874 1.00 0.00 C ATOM 1518 CD2 TRP A 101 17.817 -4.416 -18.855 1.00 0.00 C ATOM 1519 NE1 TRP A 101 18.477 -5.666 -17.152 1.00 0.00 N ATOM 1520 CE2 TRP A 101 17.340 -5.124 -17.710 1.00 0.00 C ATOM 1521 CE3 TRP A 101 16.849 -3.778 -19.664 1.00 0.00 C ATOM 1522 CZ2 TRP A 101 15.979 -5.172 -17.372 1.00 0.00 C ATOM 1523 CZ3 TRP A 101 15.478 -3.839 -19.348 1.00 0.00 C ATOM 1524 CH2 TRP A 101 15.046 -4.525 -18.199 1.00 0.00 C ATOM 0 H TRP A 101 22.556 -3.074 -18.864 1.00 0.00 H new ATOM 0 HA TRP A 101 21.559 -5.540 -20.203 1.00 0.00 H new ATOM 0 HB2 TRP A 101 20.256 -2.870 -19.729 1.00 0.00 H new ATOM 0 HB3 TRP A 101 19.704 -4.034 -20.917 1.00 0.00 H new ATOM 0 HD1 TRP A 101 20.603 -5.660 -17.637 1.00 0.00 H new ATOM 0 HE1 TRP A 101 18.485 -6.241 -16.309 1.00 0.00 H new ATOM 0 HE3 TRP A 101 17.167 -3.234 -20.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 15.653 -5.699 -16.488 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 14.756 -3.357 -19.990 1.00 0.00 H new ATOM 0 HH2 TRP A 101 13.995 -4.554 -17.952 1.00 0.00 H new ATOM 1535 N GLY A 102 23.557 -4.302 -21.633 1.00 0.00 N ATOM 1536 CA GLY A 102 24.340 -3.728 -22.712 1.00 0.00 C ATOM 1537 C GLY A 102 23.786 -4.096 -24.084 1.00 0.00 C ATOM 1538 O GLY A 102 23.511 -5.268 -24.357 1.00 0.00 O ATOM 0 H GLY A 102 24.028 -5.051 -21.125 1.00 0.00 H new ATOM 0 HA2 GLY A 102 24.358 -2.643 -22.608 1.00 0.00 H new ATOM 0 HA3 GLY A 102 25.371 -4.073 -22.634 1.00 0.00 H new ATOM 1542 N PHE A 103 23.673 -3.093 -24.954 1.00 0.00 N ATOM 1543 CA PHE A 103 23.382 -3.207 -26.376 1.00 0.00 C ATOM 1544 C PHE A 103 23.859 -1.899 -27.014 1.00 0.00 C ATOM 1545 O PHE A 103 24.096 -0.905 -26.315 1.00 0.00 O ATOM 1546 CB PHE A 103 21.890 -3.497 -26.657 1.00 0.00 C ATOM 1547 CG PHE A 103 20.898 -2.980 -25.630 1.00 0.00 C ATOM 1548 CD1 PHE A 103 20.753 -1.597 -25.421 1.00 0.00 C ATOM 1549 CD2 PHE A 103 20.150 -3.886 -24.851 1.00 0.00 C ATOM 1550 CE1 PHE A 103 19.910 -1.127 -24.401 1.00 0.00 C ATOM 1551 CE2 PHE A 103 19.294 -3.413 -23.842 1.00 0.00 C ATOM 1552 CZ PHE A 103 19.199 -2.033 -23.596 1.00 0.00 C ATOM 0 H PHE A 103 23.790 -2.122 -24.664 1.00 0.00 H new ATOM 0 HA PHE A 103 23.902 -4.061 -26.810 1.00 0.00 H new ATOM 0 HB2 PHE A 103 21.635 -3.067 -27.626 1.00 0.00 H new ATOM 0 HB3 PHE A 103 21.762 -4.576 -26.743 1.00 0.00 H new ATOM 0 HD1 PHE A 103 21.289 -0.897 -26.044 1.00 0.00 H new ATOM 0 HD2 PHE A 103 20.235 -4.948 -25.030 1.00 0.00 H new ATOM 0 HE1 PHE A 103 19.808 -0.065 -24.235 1.00 0.00 H new ATOM 0 HE2 PHE A 103 18.711 -4.109 -23.257 1.00 0.00 H new ATOM 0 HZ PHE A 103 18.580 -1.669 -22.789 1.00 0.00 H new ATOM 1562 N ASP A 104 24.056 -1.914 -28.331 1.00 0.00 N ATOM 1563 CA ASP A 104 24.631 -0.790 -29.048 1.00 0.00 C ATOM 1564 C ASP A 104 23.679 0.397 -29.050 1.00 0.00 C ATOM 1565 O ASP A 104 22.459 0.238 -29.130 1.00 0.00 O ATOM 1566 CB ASP A 104 25.039 -1.180 -30.472 1.00 0.00 C ATOM 1567 CG ASP A 104 25.799 -0.047 -31.189 1.00 0.00 C ATOM 1568 OD1 ASP A 104 26.572 0.680 -30.525 1.00 0.00 O ATOM 1569 OD2 ASP A 104 25.665 0.056 -32.429 1.00 0.00 O ATOM 0 H ASP A 104 23.820 -2.708 -28.926 1.00 0.00 H new ATOM 0 HA ASP A 104 25.538 -0.491 -28.523 1.00 0.00 H new ATOM 0 HB2 ASP A 104 25.666 -2.071 -30.438 1.00 0.00 H new ATOM 0 HB3 ASP A 104 24.149 -1.438 -31.046 1.00 0.00 H new ATOM 1574 N ASP A 105 24.249 1.592 -28.948 1.00 0.00 N ATOM 1575 CA ASP A 105 23.480 2.827 -29.029 1.00 0.00 C ATOM 1576 C ASP A 105 22.973 3.001 -30.461 1.00 0.00 C ATOM 1577 O ASP A 105 23.784 2.955 -31.389 1.00 0.00 O ATOM 1578 CB ASP A 105 24.301 4.055 -28.631 1.00 0.00 C ATOM 1579 CG ASP A 105 23.333 5.204 -28.327 1.00 0.00 C ATOM 1580 OD1 ASP A 105 22.776 5.783 -29.284 1.00 0.00 O ATOM 1581 OD2 ASP A 105 23.078 5.438 -27.122 1.00 0.00 O ATOM 0 H ASP A 105 25.250 1.731 -28.808 1.00 0.00 H new ATOM 0 HA ASP A 105 22.650 2.749 -28.326 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.915 3.835 -27.758 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.981 4.334 -29.436 1.00 0.00 H new ATOM 1586 N PRO A 106 21.669 3.213 -30.694 1.00 0.00 N ATOM 1587 CA PRO A 106 21.157 3.334 -32.048 1.00 0.00 C ATOM 1588 C PRO A 106 21.694 4.564 -32.795 1.00 0.00 C ATOM 1589 O PRO A 106 21.795 4.524 -34.022 1.00 0.00 O ATOM 1590 CB PRO A 106 19.639 3.319 -31.906 1.00 0.00 C ATOM 1591 CG PRO A 106 19.369 3.751 -30.464 1.00 0.00 C ATOM 1592 CD PRO A 106 20.597 3.248 -29.715 1.00 0.00 C ATOM 0 HA PRO A 106 21.499 2.511 -32.675 1.00 0.00 H new ATOM 0 HB2 PRO A 106 19.170 4.000 -32.616 1.00 0.00 H new ATOM 0 HB3 PRO A 106 19.235 2.326 -32.102 1.00 0.00 H new ATOM 0 HG2 PRO A 106 19.262 4.833 -30.381 1.00 0.00 H new ATOM 0 HG3 PRO A 106 18.451 3.309 -30.076 1.00 0.00 H new ATOM 0 HD2 PRO A 106 20.847 3.909 -28.885 1.00 0.00 H new ATOM 0 HD3 PRO A 106 20.420 2.259 -29.293 1.00 0.00 H new ATOM 1600 N ALA A 107 22.134 5.617 -32.094 1.00 0.00 N ATOM 1601 CA ALA A 107 22.814 6.747 -32.720 1.00 0.00 C ATOM 1602 C ALA A 107 24.204 6.368 -33.257 1.00 0.00 C ATOM 1603 O ALA A 107 24.777 7.123 -34.044 1.00 0.00 O ATOM 1604 CB ALA A 107 22.933 7.918 -31.738 1.00 0.00 C ATOM 0 H ALA A 107 22.027 5.705 -31.083 1.00 0.00 H new ATOM 0 HA ALA A 107 22.204 7.050 -33.571 1.00 0.00 H new ATOM 0 HB1 ALA A 107 23.443 8.750 -32.224 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.937 8.234 -31.427 1.00 0.00 H new ATOM 0 HB3 ALA A 107 23.504 7.604 -30.864 1.00 0.00 H new ATOM 1610 N ARG A 108 24.757 5.215 -32.856 1.00 0.00 N ATOM 1611 CA ARG A 108 26.098 4.747 -33.228 1.00 0.00 C ATOM 1612 C ARG A 108 26.025 3.547 -34.175 1.00 0.00 C ATOM 1613 O ARG A 108 27.076 3.029 -34.561 1.00 0.00 O ATOM 1614 CB ARG A 108 26.917 4.419 -31.960 1.00 0.00 C ATOM 1615 CG ARG A 108 27.112 5.661 -31.079 1.00 0.00 C ATOM 1616 CD ARG A 108 27.976 5.390 -29.840 1.00 0.00 C ATOM 1617 NE ARG A 108 28.160 6.642 -29.085 1.00 0.00 N ATOM 1618 CZ ARG A 108 27.961 6.831 -27.775 1.00 0.00 C ATOM 1619 NH1 ARG A 108 27.813 5.809 -26.939 1.00 0.00 N ATOM 1620 NH2 ARG A 108 27.906 8.073 -27.303 1.00 0.00 N ATOM 0 H ARG A 108 24.267 4.562 -32.244 1.00 0.00 H new ATOM 0 HA ARG A 108 26.607 5.547 -33.766 1.00 0.00 H new ATOM 0 HB2 ARG A 108 26.409 3.642 -31.388 1.00 0.00 H new ATOM 0 HB3 ARG A 108 27.889 4.019 -32.247 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.574 6.451 -31.671 1.00 0.00 H new ATOM 0 HG3 ARG A 108 26.137 6.030 -30.761 1.00 0.00 H new ATOM 0 HD2 ARG A 108 27.500 4.639 -29.209 1.00 0.00 H new ATOM 0 HD3 ARG A 108 28.944 4.988 -30.139 1.00 0.00 H new ATOM 0 HE ARG A 108 28.473 7.453 -29.619 1.00 0.00 H new ATOM 0 HH11 ARG A 108 27.850 4.852 -27.291 1.00 0.00 H new ATOM 0 HH12 ARG A 108 27.663 5.981 -25.945 1.00 0.00 H new ATOM 0 HH21 ARG A 108 28.015 8.865 -27.937 1.00 0.00 H new ATOM 0 HH22 ARG A 108 27.755 8.234 -26.307 1.00 0.00 H new ATOM 1634 N ALA A 109 24.820 3.143 -34.592 1.00 0.00 N ATOM 1635 CA ALA A 109 24.549 2.091 -35.561 1.00 0.00 C ATOM 1636 C ALA A 109 24.917 2.539 -36.988 1.00 0.00 C ATOM 1637 O ALA A 109 24.055 2.686 -37.856 1.00 0.00 O ATOM 1638 CB ALA A 109 23.080 1.681 -35.437 1.00 0.00 C ATOM 0 H ALA A 109 23.964 3.570 -34.238 1.00 0.00 H new ATOM 0 HA ALA A 109 25.173 1.222 -35.351 1.00 0.00 H new ATOM 0 HB1 ALA A 109 22.860 0.893 -36.157 1.00 0.00 H new ATOM 0 HB2 ALA A 109 22.888 1.315 -34.428 1.00 0.00 H new ATOM 0 HB3 ALA A 109 22.444 2.543 -35.637 1.00 0.00 H new ATOM 1644 N GLN A 110 26.196 2.840 -37.200 1.00 0.00 N ATOM 1645 CA GLN A 110 26.738 3.450 -38.403 1.00 0.00 C ATOM 1646 C GLN A 110 26.449 2.579 -39.629 1.00 0.00 C ATOM 1647 O GLN A 110 26.583 1.352 -39.596 1.00 0.00 O ATOM 1648 CB GLN A 110 28.251 3.658 -38.207 1.00 0.00 C ATOM 1649 CG GLN A 110 28.567 4.749 -37.165 1.00 0.00 C ATOM 1650 CD GLN A 110 29.870 4.458 -36.419 1.00 0.00 C ATOM 1651 OE1 GLN A 110 30.956 4.848 -36.845 1.00 0.00 O ATOM 1652 NE2 GLN A 110 29.795 3.758 -35.297 1.00 0.00 N ATOM 0 H GLN A 110 26.915 2.654 -36.500 1.00 0.00 H new ATOM 0 HA GLN A 110 26.262 4.415 -38.577 1.00 0.00 H new ATOM 0 HB2 GLN A 110 28.706 2.718 -37.894 1.00 0.00 H new ATOM 0 HB3 GLN A 110 28.704 3.929 -39.161 1.00 0.00 H new ATOM 0 HG2 GLN A 110 28.640 5.716 -37.662 1.00 0.00 H new ATOM 0 HG3 GLN A 110 27.747 4.819 -36.451 1.00 0.00 H new ATOM 0 HE21 GLN A 110 28.889 3.440 -34.954 1.00 0.00 H new ATOM 0 HE22 GLN A 110 30.644 3.537 -34.776 1.00 0.00 H new ATOM 1661 N GLY A 111 26.082 3.248 -40.719 1.00 0.00 N ATOM 1662 CA GLY A 111 25.836 2.668 -42.031 1.00 0.00 C ATOM 1663 C GLY A 111 25.182 3.731 -42.906 1.00 0.00 C ATOM 1664 O GLY A 111 25.761 4.156 -43.906 1.00 0.00 O ATOM 0 H GLY A 111 25.942 4.258 -40.708 1.00 0.00 H new ATOM 0 HA2 GLY A 111 26.771 2.330 -42.478 1.00 0.00 H new ATOM 0 HA3 GLY A 111 25.189 1.795 -41.946 1.00 0.00 H new ATOM 1668 N THR A 112 24.022 4.224 -42.468 1.00 0.00 N ATOM 1669 CA THR A 112 23.325 5.382 -43.017 1.00 0.00 C ATOM 1670 C THR A 112 22.265 5.805 -41.996 1.00 0.00 C ATOM 1671 O THR A 112 21.979 5.061 -41.055 1.00 0.00 O ATOM 1672 CB THR A 112 22.778 5.073 -44.434 1.00 0.00 C ATOM 1673 OG1 THR A 112 22.090 6.191 -44.962 1.00 0.00 O ATOM 1674 CG2 THR A 112 21.846 3.857 -44.497 1.00 0.00 C ATOM 0 H THR A 112 23.522 3.805 -41.684 1.00 0.00 H new ATOM 0 HA THR A 112 23.995 6.228 -43.169 1.00 0.00 H new ATOM 0 HB THR A 112 23.661 4.839 -45.029 1.00 0.00 H new ATOM 0 HG1 THR A 112 21.754 5.976 -45.857 1.00 0.00 H new ATOM 0 HG21 THR A 112 21.508 3.710 -45.523 1.00 0.00 H new ATOM 0 HG22 THR A 112 22.383 2.970 -44.161 1.00 0.00 H new ATOM 0 HG23 THR A 112 20.984 4.026 -43.852 1.00 0.00 H new ATOM 1682 N GLU A 113 21.675 6.988 -42.163 1.00 0.00 N ATOM 1683 CA GLU A 113 20.648 7.501 -41.262 1.00 0.00 C ATOM 1684 C GLU A 113 19.419 6.586 -41.241 1.00 0.00 C ATOM 1685 O GLU A 113 18.770 6.453 -40.204 1.00 0.00 O ATOM 1686 CB GLU A 113 20.290 8.954 -41.616 1.00 0.00 C ATOM 1687 CG GLU A 113 19.688 9.142 -43.018 1.00 0.00 C ATOM 1688 CD GLU A 113 19.416 10.627 -43.319 1.00 0.00 C ATOM 1689 OE1 GLU A 113 18.301 11.119 -43.029 1.00 0.00 O ATOM 1690 OE2 GLU A 113 20.306 11.318 -43.865 1.00 0.00 O ATOM 0 H GLU A 113 21.899 7.620 -42.932 1.00 0.00 H new ATOM 0 HA GLU A 113 21.050 7.506 -40.249 1.00 0.00 H new ATOM 0 HB2 GLU A 113 19.582 9.330 -40.878 1.00 0.00 H new ATOM 0 HB3 GLU A 113 21.189 9.566 -41.536 1.00 0.00 H new ATOM 0 HG2 GLU A 113 20.370 8.737 -43.766 1.00 0.00 H new ATOM 0 HG3 GLU A 113 18.759 8.578 -43.095 1.00 0.00 H new ATOM 1697 N GLU A 114 19.126 5.909 -42.356 1.00 0.00 N ATOM 1698 CA GLU A 114 18.038 4.945 -42.431 1.00 0.00 C ATOM 1699 C GLU A 114 18.361 3.709 -41.585 1.00 0.00 C ATOM 1700 O GLU A 114 17.487 3.177 -40.904 1.00 0.00 O ATOM 1701 CB GLU A 114 17.774 4.581 -43.901 1.00 0.00 C ATOM 1702 CG GLU A 114 16.537 3.689 -44.065 1.00 0.00 C ATOM 1703 CD GLU A 114 16.218 3.433 -45.549 1.00 0.00 C ATOM 1704 OE1 GLU A 114 16.741 2.457 -46.132 1.00 0.00 O ATOM 1705 OE2 GLU A 114 15.423 4.194 -46.147 1.00 0.00 O ATOM 0 H GLU A 114 19.641 6.018 -43.230 1.00 0.00 H new ATOM 0 HA GLU A 114 17.128 5.386 -42.023 1.00 0.00 H new ATOM 0 HB2 GLU A 114 17.641 5.494 -44.481 1.00 0.00 H new ATOM 0 HB3 GLU A 114 18.646 4.069 -44.309 1.00 0.00 H new ATOM 0 HG2 GLU A 114 16.703 2.738 -43.558 1.00 0.00 H new ATOM 0 HG3 GLU A 114 15.680 4.161 -43.584 1.00 0.00 H new ATOM 1712 N GLU A 115 19.622 3.271 -41.587 1.00 0.00 N ATOM 1713 CA GLU A 115 20.072 2.134 -40.801 1.00 0.00 C ATOM 1714 C GLU A 115 20.067 2.511 -39.318 1.00 0.00 C ATOM 1715 O GLU A 115 19.576 1.742 -38.494 1.00 0.00 O ATOM 1716 CB GLU A 115 21.461 1.684 -41.283 1.00 0.00 C ATOM 1717 CG GLU A 115 21.931 0.364 -40.660 1.00 0.00 C ATOM 1718 CD GLU A 115 21.066 -0.837 -41.088 1.00 0.00 C ATOM 1719 OE1 GLU A 115 21.353 -1.444 -42.146 1.00 0.00 O ATOM 1720 OE2 GLU A 115 20.107 -1.192 -40.365 1.00 0.00 O ATOM 0 H GLU A 115 20.361 3.703 -42.141 1.00 0.00 H new ATOM 0 HA GLU A 115 19.395 1.290 -40.933 1.00 0.00 H new ATOM 0 HB2 GLU A 115 21.443 1.578 -42.368 1.00 0.00 H new ATOM 0 HB3 GLU A 115 22.187 2.464 -41.051 1.00 0.00 H new ATOM 0 HG2 GLU A 115 22.967 0.181 -40.946 1.00 0.00 H new ATOM 0 HG3 GLU A 115 21.911 0.452 -39.574 1.00 0.00 H new ATOM 1727 N LYS A 116 20.528 3.720 -38.972 1.00 0.00 N ATOM 1728 CA LYS A 116 20.422 4.243 -37.616 1.00 0.00 C ATOM 1729 C LYS A 116 18.967 4.243 -37.167 1.00 0.00 C ATOM 1730 O LYS A 116 18.667 3.667 -36.125 1.00 0.00 O ATOM 1731 CB LYS A 116 21.048 5.643 -37.515 1.00 0.00 C ATOM 1732 CG LYS A 116 22.580 5.582 -37.520 1.00 0.00 C ATOM 1733 CD LYS A 116 23.182 6.953 -37.193 1.00 0.00 C ATOM 1734 CE LYS A 116 24.711 6.887 -37.301 1.00 0.00 C ATOM 1735 NZ LYS A 116 25.364 8.057 -36.661 1.00 0.00 N ATOM 0 H LYS A 116 20.983 4.357 -39.627 1.00 0.00 H new ATOM 0 HA LYS A 116 20.982 3.593 -36.944 1.00 0.00 H new ATOM 0 HB2 LYS A 116 20.706 6.256 -38.349 1.00 0.00 H new ATOM 0 HB3 LYS A 116 20.706 6.129 -36.601 1.00 0.00 H new ATOM 0 HG2 LYS A 116 22.921 4.847 -36.791 1.00 0.00 H new ATOM 0 HG3 LYS A 116 22.932 5.249 -38.497 1.00 0.00 H new ATOM 0 HD2 LYS A 116 22.792 7.705 -37.879 1.00 0.00 H new ATOM 0 HD3 LYS A 116 22.892 7.258 -36.187 1.00 0.00 H new ATOM 0 HE2 LYS A 116 25.069 5.970 -36.832 1.00 0.00 H new ATOM 0 HE3 LYS A 116 24.999 6.841 -38.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 26.365 8.092 -36.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 24.888 8.930 -36.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 25.297 7.969 -35.627 1.00 0.00 H new ATOM 1749 N TRP A 117 18.051 4.823 -37.947 1.00 0.00 N ATOM 1750 CA TRP A 117 16.625 4.831 -37.632 1.00 0.00 C ATOM 1751 C TRP A 117 16.085 3.407 -37.461 1.00 0.00 C ATOM 1752 O TRP A 117 15.313 3.154 -36.532 1.00 0.00 O ATOM 1753 CB TRP A 117 15.861 5.604 -38.717 1.00 0.00 C ATOM 1754 CG TRP A 117 14.370 5.431 -38.731 1.00 0.00 C ATOM 1755 CD1 TRP A 117 13.651 5.051 -39.811 1.00 0.00 C ATOM 1756 CD2 TRP A 117 13.399 5.558 -37.640 1.00 0.00 C ATOM 1757 NE1 TRP A 117 12.320 4.936 -39.475 1.00 0.00 N ATOM 1758 CE2 TRP A 117 12.105 5.224 -38.145 1.00 0.00 C ATOM 1759 CE3 TRP A 117 13.476 5.890 -36.269 1.00 0.00 C ATOM 1760 CZ2 TRP A 117 10.960 5.209 -37.333 1.00 0.00 C ATOM 1761 CZ3 TRP A 117 12.337 5.865 -35.443 1.00 0.00 C ATOM 1762 CH2 TRP A 117 11.079 5.523 -35.970 1.00 0.00 C ATOM 0 H TRP A 117 18.281 5.302 -38.818 1.00 0.00 H new ATOM 0 HA TRP A 117 16.476 5.338 -36.679 1.00 0.00 H new ATOM 0 HB2 TRP A 117 16.081 6.665 -38.601 1.00 0.00 H new ATOM 0 HB3 TRP A 117 16.250 5.303 -39.690 1.00 0.00 H new ATOM 0 HD1 TRP A 117 14.060 4.865 -40.793 1.00 0.00 H new ATOM 0 HE1 TRP A 117 11.585 4.670 -40.130 1.00 0.00 H new ATOM 0 HE3 TRP A 117 14.430 6.169 -35.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 9.997 4.958 -37.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 12.430 6.111 -34.395 1.00 0.00 H new ATOM 0 HH2 TRP A 117 10.209 5.502 -35.330 1.00 0.00 H new ATOM 1773 N ALA A 118 16.511 2.459 -38.299 1.00 0.00 N ATOM 1774 CA ALA A 118 16.082 1.077 -38.178 1.00 0.00 C ATOM 1775 C ALA A 118 16.577 0.485 -36.857 1.00 0.00 C ATOM 1776 O ALA A 118 15.827 -0.189 -36.154 1.00 0.00 O ATOM 1777 CB ALA A 118 16.541 0.269 -39.393 1.00 0.00 C ATOM 0 H ALA A 118 17.156 2.632 -39.070 1.00 0.00 H new ATOM 0 HA ALA A 118 14.993 1.034 -38.161 1.00 0.00 H new ATOM 0 HB1 ALA A 118 16.212 -0.765 -39.288 1.00 0.00 H new ATOM 0 HB2 ALA A 118 16.110 0.697 -40.298 1.00 0.00 H new ATOM 0 HB3 ALA A 118 17.629 0.299 -39.460 1.00 0.00 H new ATOM 1783 N PHE A 119 17.811 0.785 -36.462 1.00 0.00 N ATOM 1784 CA PHE A 119 18.325 0.393 -35.165 1.00 0.00 C ATOM 1785 C PHE A 119 17.633 1.104 -34.006 1.00 0.00 C ATOM 1786 O PHE A 119 17.502 0.485 -32.956 1.00 0.00 O ATOM 1787 CB PHE A 119 19.851 0.498 -35.100 1.00 0.00 C ATOM 1788 CG PHE A 119 20.520 -0.785 -35.557 1.00 0.00 C ATOM 1789 CD1 PHE A 119 20.540 -1.904 -34.702 1.00 0.00 C ATOM 1790 CD2 PHE A 119 21.081 -0.886 -36.843 1.00 0.00 C ATOM 1791 CE1 PHE A 119 21.119 -3.112 -35.130 1.00 0.00 C ATOM 1792 CE2 PHE A 119 21.678 -2.088 -37.265 1.00 0.00 C ATOM 1793 CZ PHE A 119 21.692 -3.204 -36.410 1.00 0.00 C ATOM 0 H PHE A 119 18.476 1.305 -37.034 1.00 0.00 H new ATOM 0 HA PHE A 119 18.078 -0.662 -35.043 1.00 0.00 H new ATOM 0 HB2 PHE A 119 20.186 1.326 -35.725 1.00 0.00 H new ATOM 0 HB3 PHE A 119 20.157 0.725 -34.079 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.109 -1.834 -33.714 1.00 0.00 H new ATOM 0 HD2 PHE A 119 21.053 -0.037 -37.510 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.123 -3.970 -34.474 1.00 0.00 H new ATOM 0 HE2 PHE A 119 22.126 -2.153 -38.246 1.00 0.00 H new ATOM 0 HZ PHE A 119 22.142 -4.130 -36.736 1.00 0.00 H new ATOM 1803 N PHE A 120 17.133 2.332 -34.157 1.00 0.00 N ATOM 1804 CA PHE A 120 16.342 2.966 -33.102 1.00 0.00 C ATOM 1805 C PHE A 120 15.100 2.133 -32.817 1.00 0.00 C ATOM 1806 O PHE A 120 14.877 1.778 -31.662 1.00 0.00 O ATOM 1807 CB PHE A 120 15.974 4.425 -33.432 1.00 0.00 C ATOM 1808 CG PHE A 120 16.994 5.448 -32.973 1.00 0.00 C ATOM 1809 CD1 PHE A 120 16.957 5.928 -31.649 1.00 0.00 C ATOM 1810 CD2 PHE A 120 17.982 5.925 -33.856 1.00 0.00 C ATOM 1811 CE1 PHE A 120 17.908 6.869 -31.216 1.00 0.00 C ATOM 1812 CE2 PHE A 120 18.949 6.843 -33.416 1.00 0.00 C ATOM 1813 CZ PHE A 120 18.906 7.318 -32.096 1.00 0.00 C ATOM 0 H PHE A 120 17.261 2.903 -34.993 1.00 0.00 H new ATOM 0 HA PHE A 120 16.959 3.006 -32.204 1.00 0.00 H new ATOM 0 HB2 PHE A 120 15.843 4.519 -34.510 1.00 0.00 H new ATOM 0 HB3 PHE A 120 15.013 4.657 -32.973 1.00 0.00 H new ATOM 0 HD1 PHE A 120 16.199 5.573 -30.967 1.00 0.00 H new ATOM 0 HD2 PHE A 120 17.996 5.582 -34.880 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.871 7.247 -30.205 1.00 0.00 H new ATOM 0 HE2 PHE A 120 19.722 7.182 -34.090 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.643 8.031 -31.756 1.00 0.00 H new ATOM 1823 N GLN A 121 14.322 1.762 -33.838 1.00 0.00 N ATOM 1824 CA GLN A 121 13.135 0.939 -33.613 1.00 0.00 C ATOM 1825 C GLN A 121 13.496 -0.469 -33.108 1.00 0.00 C ATOM 1826 O GLN A 121 12.769 -1.009 -32.272 1.00 0.00 O ATOM 1827 CB GLN A 121 12.197 0.941 -34.829 1.00 0.00 C ATOM 1828 CG GLN A 121 12.830 0.516 -36.156 1.00 0.00 C ATOM 1829 CD GLN A 121 11.864 0.708 -37.322 1.00 0.00 C ATOM 1830 OE1 GLN A 121 11.278 -0.243 -37.836 1.00 0.00 O ATOM 1831 NE2 GLN A 121 11.690 1.941 -37.768 1.00 0.00 N ATOM 0 H GLN A 121 14.490 2.014 -34.812 1.00 0.00 H new ATOM 0 HA GLN A 121 12.565 1.398 -32.805 1.00 0.00 H new ATOM 0 HB2 GLN A 121 11.358 0.278 -34.619 1.00 0.00 H new ATOM 0 HB3 GLN A 121 11.788 1.944 -34.948 1.00 0.00 H new ATOM 0 HG2 GLN A 121 13.735 1.098 -36.332 1.00 0.00 H new ATOM 0 HG3 GLN A 121 13.130 -0.530 -36.099 1.00 0.00 H new ATOM 0 HE21 GLN A 121 12.185 2.717 -37.328 1.00 0.00 H new ATOM 0 HE22 GLN A 121 11.061 2.116 -38.551 1.00 0.00 H new ATOM 1840 N ARG A 122 14.628 -1.050 -33.533 1.00 0.00 N ATOM 1841 CA ARG A 122 15.081 -2.343 -33.005 1.00 0.00 C ATOM 1842 C ARG A 122 15.441 -2.231 -31.525 1.00 0.00 C ATOM 1843 O ARG A 122 14.930 -3.009 -30.722 1.00 0.00 O ATOM 1844 CB ARG A 122 16.288 -2.884 -33.796 1.00 0.00 C ATOM 1845 CG ARG A 122 15.956 -3.317 -35.235 1.00 0.00 C ATOM 1846 CD ARG A 122 17.243 -3.505 -36.054 1.00 0.00 C ATOM 1847 NE ARG A 122 16.959 -3.674 -37.492 1.00 0.00 N ATOM 1848 CZ ARG A 122 17.642 -3.126 -38.510 1.00 0.00 C ATOM 1849 NH1 ARG A 122 18.723 -2.384 -38.297 1.00 0.00 N ATOM 1850 NH2 ARG A 122 17.239 -3.314 -39.761 1.00 0.00 N ATOM 0 H ARG A 122 15.244 -0.646 -34.238 1.00 0.00 H new ATOM 0 HA ARG A 122 14.254 -3.045 -33.117 1.00 0.00 H new ATOM 0 HB2 ARG A 122 17.061 -2.116 -33.829 1.00 0.00 H new ATOM 0 HB3 ARG A 122 16.707 -3.735 -33.260 1.00 0.00 H new ATOM 0 HG2 ARG A 122 15.390 -4.248 -35.219 1.00 0.00 H new ATOM 0 HG3 ARG A 122 15.323 -2.567 -35.709 1.00 0.00 H new ATOM 0 HD2 ARG A 122 17.894 -2.642 -35.911 1.00 0.00 H new ATOM 0 HD3 ARG A 122 17.784 -4.377 -35.686 1.00 0.00 H new ATOM 0 HE ARG A 122 16.165 -4.266 -37.737 1.00 0.00 H new ATOM 0 HH11 ARG A 122 19.050 -2.221 -37.345 1.00 0.00 H new ATOM 0 HH12 ARG A 122 19.226 -1.978 -39.086 1.00 0.00 H new ATOM 0 HH21 ARG A 122 16.409 -3.876 -39.950 1.00 0.00 H new ATOM 0 HH22 ARG A 122 17.759 -2.897 -40.533 1.00 0.00 H new ATOM 1864 N VAL A 123 16.286 -1.269 -31.141 1.00 0.00 N ATOM 1865 CA VAL A 123 16.733 -1.135 -29.760 1.00 0.00 C ATOM 1866 C VAL A 123 15.533 -0.756 -28.888 1.00 0.00 C ATOM 1867 O VAL A 123 15.392 -1.297 -27.795 1.00 0.00 O ATOM 1868 CB VAL A 123 17.916 -0.142 -29.676 1.00 0.00 C ATOM 1869 CG1 VAL A 123 18.334 0.155 -28.229 1.00 0.00 C ATOM 1870 CG2 VAL A 123 19.157 -0.697 -30.399 1.00 0.00 C ATOM 0 H VAL A 123 16.673 -0.570 -31.775 1.00 0.00 H new ATOM 0 HA VAL A 123 17.119 -2.080 -29.377 1.00 0.00 H new ATOM 0 HB VAL A 123 17.561 0.773 -30.150 1.00 0.00 H new ATOM 0 HG11 VAL A 123 19.168 0.857 -28.228 1.00 0.00 H new ATOM 0 HG12 VAL A 123 17.493 0.590 -27.689 1.00 0.00 H new ATOM 0 HG13 VAL A 123 18.639 -0.771 -27.741 1.00 0.00 H new ATOM 0 HG21 VAL A 123 19.973 0.021 -30.324 1.00 0.00 H new ATOM 0 HG22 VAL A 123 19.457 -1.637 -29.936 1.00 0.00 H new ATOM 0 HG23 VAL A 123 18.920 -0.869 -31.449 1.00 0.00 H new ATOM 1880 N ARG A 124 14.619 0.091 -29.382 1.00 0.00 N ATOM 1881 CA ARG A 124 13.366 0.410 -28.706 1.00 0.00 C ATOM 1882 C ARG A 124 12.610 -0.875 -28.400 1.00 0.00 C ATOM 1883 O ARG A 124 12.202 -1.071 -27.259 1.00 0.00 O ATOM 1884 CB ARG A 124 12.549 1.338 -29.622 1.00 0.00 C ATOM 1885 CG ARG A 124 11.106 1.612 -29.161 1.00 0.00 C ATOM 1886 CD ARG A 124 10.120 1.648 -30.333 1.00 0.00 C ATOM 1887 NE ARG A 124 9.999 0.359 -31.045 1.00 0.00 N ATOM 1888 CZ ARG A 124 9.569 0.242 -32.308 1.00 0.00 C ATOM 1889 NH1 ARG A 124 9.139 1.320 -32.951 1.00 0.00 N ATOM 1890 NH2 ARG A 124 9.584 -0.933 -32.927 1.00 0.00 N ATOM 0 H ARG A 124 14.736 0.576 -30.272 1.00 0.00 H new ATOM 0 HA ARG A 124 13.552 0.918 -27.760 1.00 0.00 H new ATOM 0 HB2 ARG A 124 13.073 2.290 -29.708 1.00 0.00 H new ATOM 0 HB3 ARG A 124 12.517 0.901 -30.620 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.800 0.841 -28.455 1.00 0.00 H new ATOM 0 HG3 ARG A 124 11.071 2.563 -28.630 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.138 1.942 -29.962 1.00 0.00 H new ATOM 0 HD3 ARG A 124 10.436 2.415 -31.040 1.00 0.00 H new ATOM 0 HE ARG A 124 10.258 -0.492 -30.545 1.00 0.00 H new ATOM 0 HH11 ARG A 124 9.138 2.226 -32.483 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.809 1.242 -33.913 1.00 0.00 H new ATOM 0 HH21 ARG A 124 9.926 -1.762 -32.440 1.00 0.00 H new ATOM 0 HH22 ARG A 124 9.253 -1.007 -33.889 1.00 0.00 H new ATOM 1904 N ASP A 125 12.378 -1.714 -29.409 1.00 0.00 N ATOM 1905 CA ASP A 125 11.564 -2.911 -29.241 1.00 0.00 C ATOM 1906 C ASP A 125 12.207 -3.874 -28.243 1.00 0.00 C ATOM 1907 O ASP A 125 11.522 -4.405 -27.370 1.00 0.00 O ATOM 1908 CB ASP A 125 11.355 -3.612 -30.587 1.00 0.00 C ATOM 1909 CG ASP A 125 10.575 -4.924 -30.408 1.00 0.00 C ATOM 1910 OD1 ASP A 125 9.355 -4.868 -30.140 1.00 0.00 O ATOM 1911 OD2 ASP A 125 11.170 -6.012 -30.568 1.00 0.00 O ATOM 0 H ASP A 125 12.744 -1.584 -30.352 1.00 0.00 H new ATOM 0 HA ASP A 125 10.594 -2.605 -28.849 1.00 0.00 H new ATOM 0 HB2 ASP A 125 10.813 -2.952 -31.265 1.00 0.00 H new ATOM 0 HB3 ASP A 125 12.321 -3.819 -31.048 1.00 0.00 H new ATOM 1916 N GLU A 126 13.522 -4.084 -28.328 1.00 0.00 N ATOM 1917 CA GLU A 126 14.229 -4.987 -27.428 1.00 0.00 C ATOM 1918 C GLU A 126 14.209 -4.461 -25.986 1.00 0.00 C ATOM 1919 O GLU A 126 13.988 -5.239 -25.056 1.00 0.00 O ATOM 1920 CB GLU A 126 15.668 -5.208 -27.908 1.00 0.00 C ATOM 1921 CG GLU A 126 15.732 -6.059 -29.185 1.00 0.00 C ATOM 1922 CD GLU A 126 17.186 -6.331 -29.610 1.00 0.00 C ATOM 1923 OE1 GLU A 126 17.768 -5.530 -30.376 1.00 0.00 O ATOM 1924 OE2 GLU A 126 17.758 -7.367 -29.198 1.00 0.00 O ATOM 0 H GLU A 126 14.121 -3.634 -29.020 1.00 0.00 H new ATOM 0 HA GLU A 126 13.712 -5.947 -27.438 1.00 0.00 H new ATOM 0 HB2 GLU A 126 16.139 -4.243 -28.093 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.241 -5.696 -27.120 1.00 0.00 H new ATOM 0 HG2 GLU A 126 15.217 -7.005 -29.019 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.206 -5.547 -29.991 1.00 0.00 H new ATOM 1931 N ILE A 127 14.381 -3.148 -25.794 1.00 0.00 N ATOM 1932 CA ILE A 127 14.253 -2.509 -24.488 1.00 0.00 C ATOM 1933 C ILE A 127 12.842 -2.758 -23.954 1.00 0.00 C ATOM 1934 O ILE A 127 12.707 -3.228 -22.826 1.00 0.00 O ATOM 1935 CB ILE A 127 14.618 -1.008 -24.591 1.00 0.00 C ATOM 1936 CG1 ILE A 127 16.151 -0.856 -24.701 1.00 0.00 C ATOM 1937 CG2 ILE A 127 14.119 -0.189 -23.390 1.00 0.00 C ATOM 1938 CD1 ILE A 127 16.627 0.580 -24.955 1.00 0.00 C ATOM 0 H ILE A 127 14.614 -2.500 -26.546 1.00 0.00 H new ATOM 0 HA ILE A 127 14.953 -2.940 -23.773 1.00 0.00 H new ATOM 0 HB ILE A 127 14.123 -0.620 -25.481 1.00 0.00 H new ATOM 0 HG12 ILE A 127 16.607 -1.220 -23.780 1.00 0.00 H new ATOM 0 HG13 ILE A 127 16.510 -1.494 -25.509 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.404 0.855 -23.518 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.033 -0.263 -23.325 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.565 -0.577 -22.474 1.00 0.00 H new ATOM 0 HD11 ILE A 127 17.715 0.597 -25.019 1.00 0.00 H new ATOM 0 HD12 ILE A 127 16.203 0.944 -25.891 1.00 0.00 H new ATOM 0 HD13 ILE A 127 16.302 1.221 -24.136 1.00 0.00 H new ATOM 1950 N GLY A 128 11.804 -2.491 -24.754 1.00 0.00 N ATOM 1951 CA GLY A 128 10.420 -2.733 -24.376 1.00 0.00 C ATOM 1952 C GLY A 128 10.208 -4.169 -23.912 1.00 0.00 C ATOM 1953 O GLY A 128 9.627 -4.388 -22.849 1.00 0.00 O ATOM 0 H GLY A 128 11.909 -2.097 -25.689 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.135 -2.047 -23.579 1.00 0.00 H new ATOM 0 HA3 GLY A 128 9.769 -2.524 -25.225 1.00 0.00 H new ATOM 1957 N ASN A 129 10.741 -5.145 -24.656 1.00 0.00 N ATOM 1958 CA ASN A 129 10.623 -6.556 -24.300 1.00 0.00 C ATOM 1959 C ASN A 129 11.242 -6.825 -22.939 1.00 0.00 C ATOM 1960 O ASN A 129 10.603 -7.431 -22.080 1.00 0.00 O ATOM 1961 CB ASN A 129 11.265 -7.482 -25.347 1.00 0.00 C ATOM 1962 CG ASN A 129 10.337 -7.773 -26.518 1.00 0.00 C ATOM 1963 OD1 ASN A 129 9.578 -8.738 -26.502 1.00 0.00 O ATOM 1964 ND2 ASN A 129 10.378 -6.956 -27.552 1.00 0.00 N ATOM 0 H ASN A 129 11.263 -4.976 -25.516 1.00 0.00 H new ATOM 0 HA ASN A 129 9.556 -6.777 -24.266 1.00 0.00 H new ATOM 0 HB2 ASN A 129 12.181 -7.023 -25.719 1.00 0.00 H new ATOM 0 HB3 ASN A 129 11.549 -8.421 -24.871 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.773 -7.121 -28.356 1.00 0.00 H new ATOM 0 HD22 ASN A 129 11.015 -6.159 -27.548 1.00 0.00 H new ATOM 1971 N ARG A 130 12.474 -6.372 -22.706 1.00 0.00 N ATOM 1972 CA ARG A 130 13.123 -6.662 -21.433 1.00 0.00 C ATOM 1973 C ARG A 130 12.479 -5.897 -20.292 1.00 0.00 C ATOM 1974 O ARG A 130 12.462 -6.439 -19.187 1.00 0.00 O ATOM 1975 CB ARG A 130 14.642 -6.434 -21.499 1.00 0.00 C ATOM 1976 CG ARG A 130 15.371 -7.677 -22.025 1.00 0.00 C ATOM 1977 CD ARG A 130 15.345 -8.854 -21.031 1.00 0.00 C ATOM 1978 NE ARG A 130 16.255 -8.653 -19.887 1.00 0.00 N ATOM 1979 CZ ARG A 130 15.911 -8.535 -18.596 1.00 0.00 C ATOM 1980 NH1 ARG A 130 14.667 -8.250 -18.223 1.00 0.00 N ATOM 1981 NH2 ARG A 130 16.831 -8.731 -17.659 1.00 0.00 N ATOM 0 H ARG A 130 13.027 -5.819 -23.361 1.00 0.00 H new ATOM 0 HA ARG A 130 12.976 -7.722 -21.229 1.00 0.00 H new ATOM 0 HB2 ARG A 130 14.856 -5.583 -22.146 1.00 0.00 H new ATOM 0 HB3 ARG A 130 15.017 -6.182 -20.507 1.00 0.00 H new ATOM 0 HG2 ARG A 130 14.913 -7.990 -22.963 1.00 0.00 H new ATOM 0 HG3 ARG A 130 16.406 -7.418 -22.246 1.00 0.00 H new ATOM 0 HD2 ARG A 130 14.328 -8.990 -20.662 1.00 0.00 H new ATOM 0 HD3 ARG A 130 15.620 -9.771 -21.552 1.00 0.00 H new ATOM 0 HE ARG A 130 17.251 -8.598 -20.101 1.00 0.00 H new ATOM 0 HH11 ARG A 130 13.942 -8.114 -18.927 1.00 0.00 H new ATOM 0 HH12 ARG A 130 14.438 -8.167 -17.233 1.00 0.00 H new ATOM 0 HH21 ARG A 130 17.787 -8.968 -17.924 1.00 0.00 H new ATOM 0 HH22 ARG A 130 16.582 -8.644 -16.674 1.00 0.00 H new ATOM 1995 N LEU A 131 11.919 -4.707 -20.527 1.00 0.00 N ATOM 1996 CA LEU A 131 11.193 -3.979 -19.497 1.00 0.00 C ATOM 1997 C LEU A 131 9.907 -4.722 -19.136 1.00 0.00 C ATOM 1998 O LEU A 131 9.580 -4.826 -17.955 1.00 0.00 O ATOM 1999 CB LEU A 131 10.891 -2.531 -19.926 1.00 0.00 C ATOM 2000 CG LEU A 131 11.250 -1.491 -18.853 1.00 0.00 C ATOM 2001 CD1 LEU A 131 10.601 -1.774 -17.492 1.00 0.00 C ATOM 2002 CD2 LEU A 131 12.768 -1.351 -18.705 1.00 0.00 C ATOM 0 H LEU A 131 11.958 -4.230 -21.428 1.00 0.00 H new ATOM 0 HA LEU A 131 11.828 -3.925 -18.613 1.00 0.00 H new ATOM 0 HB2 LEU A 131 11.444 -2.307 -20.838 1.00 0.00 H new ATOM 0 HB3 LEU A 131 9.831 -2.444 -20.166 1.00 0.00 H new ATOM 0 HG LEU A 131 10.839 -0.545 -19.204 1.00 0.00 H new ATOM 0 HD11 LEU A 131 10.896 -1.002 -16.781 1.00 0.00 H new ATOM 0 HD12 LEU A 131 9.516 -1.774 -17.599 1.00 0.00 H new ATOM 0 HD13 LEU A 131 10.929 -2.747 -17.128 1.00 0.00 H new ATOM 0 HD21 LEU A 131 12.992 -0.609 -17.939 1.00 0.00 H new ATOM 0 HD22 LEU A 131 13.195 -2.311 -18.416 1.00 0.00 H new ATOM 0 HD23 LEU A 131 13.198 -1.034 -19.655 1.00 0.00 H new ATOM 2014 N LYS A 132 9.206 -5.286 -20.129 1.00 0.00 N ATOM 2015 CA LYS A 132 8.047 -6.135 -19.884 1.00 0.00 C ATOM 2016 C LYS A 132 8.449 -7.282 -18.977 1.00 0.00 C ATOM 2017 O LYS A 132 7.815 -7.482 -17.946 1.00 0.00 O ATOM 2018 CB LYS A 132 7.434 -6.610 -21.211 1.00 0.00 C ATOM 2019 CG LYS A 132 6.236 -7.557 -21.030 1.00 0.00 C ATOM 2020 CD LYS A 132 5.545 -7.781 -22.384 1.00 0.00 C ATOM 2021 CE LYS A 132 4.550 -8.954 -22.405 1.00 0.00 C ATOM 2022 NZ LYS A 132 3.476 -8.854 -21.386 1.00 0.00 N ATOM 0 H LYS A 132 9.430 -5.164 -21.117 1.00 0.00 H new ATOM 0 HA LYS A 132 7.269 -5.567 -19.374 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.116 -5.741 -21.787 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.202 -7.116 -21.796 1.00 0.00 H new ATOM 0 HG2 LYS A 132 6.572 -8.510 -20.620 1.00 0.00 H new ATOM 0 HG3 LYS A 132 5.530 -7.134 -20.316 1.00 0.00 H new ATOM 0 HD2 LYS A 132 5.018 -6.869 -22.664 1.00 0.00 H new ATOM 0 HD3 LYS A 132 6.308 -7.954 -23.143 1.00 0.00 H new ATOM 0 HE2 LYS A 132 4.094 -9.013 -23.393 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.097 -9.884 -22.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.607 -9.291 -21.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.772 -9.347 -20.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 3.295 -7.853 -21.170 1.00 0.00 H new ATOM 2036 N GLU A 133 9.521 -7.999 -19.307 1.00 0.00 N ATOM 2037 CA GLU A 133 9.946 -9.137 -18.499 1.00 0.00 C ATOM 2038 C GLU A 133 10.390 -8.704 -17.107 1.00 0.00 C ATOM 2039 O GLU A 133 10.116 -9.404 -16.138 1.00 0.00 O ATOM 2040 CB GLU A 133 11.041 -9.966 -19.166 1.00 0.00 C ATOM 2041 CG GLU A 133 10.572 -10.564 -20.496 1.00 0.00 C ATOM 2042 CD GLU A 133 11.662 -11.441 -21.129 1.00 0.00 C ATOM 2043 OE1 GLU A 133 12.573 -10.903 -21.795 1.00 0.00 O ATOM 2044 OE2 GLU A 133 11.618 -12.680 -20.958 1.00 0.00 O ATOM 0 H GLU A 133 10.106 -7.814 -20.122 1.00 0.00 H new ATOM 0 HA GLU A 133 9.068 -9.775 -18.404 1.00 0.00 H new ATOM 0 HB2 GLU A 133 11.917 -9.340 -19.338 1.00 0.00 H new ATOM 0 HB3 GLU A 133 11.349 -10.768 -18.495 1.00 0.00 H new ATOM 0 HG2 GLU A 133 9.673 -11.159 -20.333 1.00 0.00 H new ATOM 0 HG3 GLU A 133 10.303 -9.762 -21.183 1.00 0.00 H new ATOM 2051 N PHE A 134 11.032 -7.554 -16.967 1.00 0.00 N ATOM 2052 CA PHE A 134 11.417 -7.033 -15.667 1.00 0.00 C ATOM 2053 C PHE A 134 10.196 -6.747 -14.793 1.00 0.00 C ATOM 2054 O PHE A 134 10.232 -6.991 -13.586 1.00 0.00 O ATOM 2055 CB PHE A 134 12.283 -5.787 -15.865 1.00 0.00 C ATOM 2056 CG PHE A 134 12.575 -5.015 -14.596 1.00 0.00 C ATOM 2057 CD1 PHE A 134 13.469 -5.531 -13.640 1.00 0.00 C ATOM 2058 CD2 PHE A 134 11.930 -3.787 -14.359 1.00 0.00 C ATOM 2059 CE1 PHE A 134 13.711 -4.818 -12.453 1.00 0.00 C ATOM 2060 CE2 PHE A 134 12.189 -3.061 -13.186 1.00 0.00 C ATOM 2061 CZ PHE A 134 13.078 -3.582 -12.229 1.00 0.00 C ATOM 0 H PHE A 134 11.300 -6.958 -17.750 1.00 0.00 H new ATOM 0 HA PHE A 134 12.000 -7.786 -15.137 1.00 0.00 H new ATOM 0 HB2 PHE A 134 13.228 -6.086 -16.319 1.00 0.00 H new ATOM 0 HB3 PHE A 134 11.786 -5.123 -16.572 1.00 0.00 H new ATOM 0 HD1 PHE A 134 13.968 -6.472 -13.818 1.00 0.00 H new ATOM 0 HD2 PHE A 134 11.230 -3.400 -15.085 1.00 0.00 H new ATOM 0 HE1 PHE A 134 14.385 -5.220 -11.711 1.00 0.00 H new ATOM 0 HE2 PHE A 134 11.709 -2.108 -13.019 1.00 0.00 H new ATOM 0 HZ PHE A 134 13.275 -3.032 -11.321 1.00 0.00 H new ATOM 2071 N ALA A 135 9.106 -6.271 -15.391 1.00 0.00 N ATOM 2072 CA ALA A 135 7.898 -5.938 -14.659 1.00 0.00 C ATOM 2073 C ALA A 135 7.069 -7.192 -14.359 1.00 0.00 C ATOM 2074 O ALA A 135 6.453 -7.298 -13.298 1.00 0.00 O ATOM 2075 CB ALA A 135 7.076 -4.938 -15.479 1.00 0.00 C ATOM 0 H ALA A 135 9.041 -6.107 -16.396 1.00 0.00 H new ATOM 0 HA ALA A 135 8.175 -5.491 -13.704 1.00 0.00 H new ATOM 0 HB1 ALA A 135 6.166 -4.683 -14.936 1.00 0.00 H new ATOM 0 HB2 ALA A 135 7.664 -4.035 -15.647 1.00 0.00 H new ATOM 0 HB3 ALA A 135 6.813 -5.384 -16.438 1.00 0.00 H new ATOM 2081 N GLU A 136 7.045 -8.133 -15.303 1.00 0.00 N ATOM 2082 CA GLU A 136 6.161 -9.290 -15.308 1.00 0.00 C ATOM 2083 C GLU A 136 6.791 -10.488 -14.601 1.00 0.00 C ATOM 2084 O GLU A 136 6.125 -11.179 -13.828 1.00 0.00 O ATOM 2085 CB GLU A 136 5.848 -9.630 -16.776 1.00 0.00 C ATOM 2086 CG GLU A 136 5.012 -10.904 -16.949 1.00 0.00 C ATOM 2087 CD GLU A 136 4.633 -11.138 -18.423 1.00 0.00 C ATOM 2088 OE1 GLU A 136 4.067 -10.224 -19.066 1.00 0.00 O ATOM 2089 OE2 GLU A 136 4.875 -12.251 -18.945 1.00 0.00 O ATOM 0 H GLU A 136 7.665 -8.106 -16.113 1.00 0.00 H new ATOM 0 HA GLU A 136 5.247 -9.054 -14.762 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.316 -8.793 -17.228 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.785 -9.744 -17.321 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.573 -11.761 -16.577 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.106 -10.830 -16.347 1.00 0.00 H new ATOM 2096 N THR A 137 8.075 -10.722 -14.863 1.00 0.00 N ATOM 2097 CA THR A 137 8.793 -11.929 -14.464 1.00 0.00 C ATOM 2098 C THR A 137 9.906 -11.613 -13.450 1.00 0.00 C ATOM 2099 O THR A 137 10.343 -12.503 -12.715 1.00 0.00 O ATOM 2100 CB THR A 137 9.319 -12.681 -15.705 1.00 0.00 C ATOM 2101 OG1 THR A 137 10.410 -12.018 -16.304 1.00 0.00 O ATOM 2102 CG2 THR A 137 8.269 -12.881 -16.802 1.00 0.00 C ATOM 0 H THR A 137 8.660 -10.059 -15.372 1.00 0.00 H new ATOM 0 HA THR A 137 8.095 -12.593 -13.954 1.00 0.00 H new ATOM 0 HB THR A 137 9.616 -13.652 -15.309 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.224 -11.057 -16.348 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.716 -13.417 -17.640 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.434 -13.459 -16.405 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.909 -11.910 -17.143 1.00 0.00 H new ATOM 2110 N GLY A 138 10.354 -10.350 -13.384 1.00 0.00 N ATOM 2111 CA GLY A 138 11.447 -9.918 -12.520 1.00 0.00 C ATOM 2112 C GLY A 138 12.829 -10.212 -13.113 1.00 0.00 C ATOM 2113 O GLY A 138 13.818 -10.149 -12.378 1.00 0.00 O ATOM 0 H GLY A 138 9.956 -9.593 -13.941 1.00 0.00 H new ATOM 0 HA2 GLY A 138 11.357 -8.847 -12.336 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.358 -10.416 -11.554 1.00 0.00 H new ATOM 2117 N LYS A 139 12.923 -10.574 -14.401 1.00 0.00 N ATOM 2118 CA LYS A 139 14.195 -10.835 -15.054 1.00 0.00 C ATOM 2119 C LYS A 139 14.966 -9.532 -15.177 1.00 0.00 C ATOM 2120 O LYS A 139 16.206 -9.558 -15.052 1.00 0.00 O ATOM 2121 CB LYS A 139 13.964 -11.471 -16.430 1.00 0.00 C ATOM 2122 CG LYS A 139 13.553 -12.949 -16.299 1.00 0.00 C ATOM 2123 CD LYS A 139 13.098 -13.570 -17.628 1.00 0.00 C ATOM 2124 CE LYS A 139 14.184 -13.451 -18.703 1.00 0.00 C ATOM 2125 NZ LYS A 139 13.784 -14.098 -19.975 1.00 0.00 N ATOM 2126 OXT LYS A 139 14.354 -8.503 -15.524 1.00 0.00 O ATOM 0 H LYS A 139 12.114 -10.691 -15.011 1.00 0.00 H new ATOM 0 HA LYS A 139 14.779 -11.536 -14.458 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.188 -10.921 -16.962 1.00 0.00 H new ATOM 0 HB3 LYS A 139 14.874 -11.395 -17.026 1.00 0.00 H new ATOM 0 HG2 LYS A 139 14.395 -13.520 -15.908 1.00 0.00 H new ATOM 0 HG3 LYS A 139 12.746 -13.032 -15.571 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.850 -14.620 -17.474 1.00 0.00 H new ATOM 0 HD3 LYS A 139 12.189 -13.075 -17.970 1.00 0.00 H new ATOM 0 HE2 LYS A 139 14.400 -12.398 -18.885 1.00 0.00 H new ATOM 0 HE3 LYS A 139 15.105 -13.907 -18.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 14.618 -14.205 -20.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 13.378 -15.035 -19.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 13.075 -13.509 -20.456 1.00 0.00 H new